ID 4H19A STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 24 24 THR A 92 92 PRO D Protein B 2 FT #SUB 24 24 THR A 95 95 GLN D Protein S 1 FT #SUB 25 25 HIS A 92 92 PRO D Protein S 6 FT #SUB 25 25 HIS A 96 96 TRP D Protein S 1 FT #SUB 30 30 TRP A 96 96 TRP D Protein S 1 FT #SUB 50 50 GLY A 96 96 TRP D Protein B 4 FT #SUB 51 51 THR A 96 96 TRP D Protein B 2 FT #SUB 52 52 HIS A 96 96 TRP D Protein S 11 FT #SUB 54 54 HIS A 93 93 SER D Protein S 4 FT #SUB 54 54 HIS A 94 94 LEU D Protein S 2 FT #SUB 56 56 PRO A 67 67 ASP D Protein S 4 FT #SUB 56 56 PRO A 68 68 CYS D Protein A 2 FT #SUB 57 57 SER A 68 68 CYS D Protein A 2 FT #SUB 57 57 SER A 94 94 LEU D Protein S 2 FT #SUB 60 60 LEU A 60 60 LEU D Protein A 2 FT #SUB 60 60 LEU A 63 63 SER D Protein S 1 FT #SUB 60 60 LEU A 64 64 CYS D Protein S 2 FT #SUB 60 60 LEU A 68 68 CYS D Protein S 1 FT #SUB 63 63 SER A 60 60 LEU D Protein S 1 FT #SUB 64 64 CYS A 60 60 LEU D Protein A 2 FT #SUB 67 67 ASP A 56 56 PRO D Protein A 4 FT #SUB 68 68 CYS A 56 56 PRO D Protein S 2 FT #SUB 68 68 CYS A 57 57 SER D Protein S 1 FT #SUB 90 90 ARG A 233 233 TRP D Protein S 3 FT #SUB 92 92 PRO A 24 24 THR D Protein S 2 FT #SUB 92 92 PRO A 25 25 HIS D Protein A 6 FT #SUB 93 93 SER A 54 54 HIS D Protein S 5 FT #SUB 94 94 LEU A 54 54 HIS D Protein S 2 FT #SUB 94 94 LEU A 57 57 SER D Protein S 2 FT #SUB 95 95 GLN A 233 233 TRP D Protein S 2 FT #SUB 95 95 GLN A 234 234 TYR D Protein S 2 FT #SUB 96 96 TRP A 25 25 HIS D Protein S 2 FT #SUB 96 96 TRP A 50 50 GLY D Protein S 4 FT #SUB 96 96 TRP A 51 51 THR D Protein S 2 FT #SUB 96 96 TRP A 52 52 HIS D Protein S 13 FT #SUB 96 96 TRP A 255 255 GLU D Protein S 2 FT #SUB 96 96 TRP A 256 256 GLN D Protein S 3 FT #SUB 96 96 TRP A 281 281 ARG D Protein A 8 FT #SUB 97 97 VAL A 101 101 GLY D Protein B 1 FT #SUB 97 97 VAL A 102 102 ILE D Protein A 3 FT #SUB 97 97 VAL A 105 105 LEU D Protein A 3 FT #SUB 97 97 VAL A 258 258 TYR D Protein B 3 FT #SUB 98 98 GLY A 258 258 TYR D Protein B 6 FT #SUB 99 99 ARG A 234 234 TYR D Protein S 2 FT #SUB 99 99 ARG A 235 235 ASP D Protein S 9 FT #SUB 99 99 ARG A 256 256 GLN D Protein S 7 FT #SUB 99 99 ARG A 258 258 TYR D Protein S 1 FT #SUB 100 100 ALA A 100 100 ALA D Protein S 1 FT #SUB 100 100 ALA A 101 101 GLY D Protein B 1 FT #SUB 101 101 GLY A 97 97 VAL D Protein B 1 FT #SUB 101 101 GLY A 100 100 ALA D Protein B 1 FT #SUB 102 102 ILE A 97 97 VAL D Protein A 4 FT #SUB 102 102 ILE A 102 102 ILE D Protein S 3 FT #SUB 105 105 LEU A 97 97 VAL D Protein S 3 FT #SUB 233 233 TRP A 90 90 ARG D Protein S 3 FT #SUB 233 233 TRP A 95 95 GLN D Protein S 2 FT #SUB 233 233 TRP A 99 99 ARG D Protein S 1 FT #SUB 233 233 TRP A 261 261 ASP D Protein S 5 FT #SUB 234 234 TYR A 95 95 GLN D Protein S 2 FT #SUB 234 234 TYR A 99 99 ARG D Protein S 1 FT #SUB 235 235 ASP A 99 99 ARG D Protein S 9 FT #SUB 235 235 ASP A 261 261 ASP D Protein A 3 FT #SUB 236 236 ASP A 264 264 ARG D Protein S 3 FT #SUB 238 238 THR A 264 264 ARG D Protein S 4 FT #SUB 255 255 GLU A 96 96 TRP D Protein S 2 FT #SUB 256 256 GLN A 96 96 TRP D Protein S 3 FT #SUB 256 256 GLN A 99 99 ARG D Protein A 7 FT #SUB 258 258 TYR A 97 97 VAL D Protein S 3 FT #SUB 258 258 TYR A 98 98 GLY D Protein S 6 FT #SUB 258 258 TYR A 99 99 ARG D Protein S 1 FT #SUB 261 261 ASP A 233 233 TRP D Protein S 6 FT #SUB 261 261 ASP A 235 235 ASP D Protein S 3 FT #SUB 264 264 ARG A 236 236 ASP D Protein S 3 FT #SUB 264 264 ARG A 238 238 THR D Protein S 4 FT #SUB 281 281 ARG A 96 96 TRP D Protein S 8 FT #SUB 181 181 ASN A 224 224 ASP F Protein S 1 FT #SUB 209 209 ASP A 301 301 PRO F Protein S 3 FT #SUB 211 211 PRO A 250 250 PRO F Protein A 3 FT #SUB 211 211 PRO A 273 273 ALA F Protein S 2 FT #SUB 211 211 PRO A 274 274 TYR F Protein S 6 FT #SUB 214 214 GLN A 247 247 THR F Protein S 1 FT #SUB 214 214 GLN A 248 248 SER F Protein A 5 FT #SUB 215 215 ARG A 225 225 ILE F Protein S 1 FT #SUB 215 215 ARG A 226 226 TYR F Protein S 14 FT #SUB 215 215 ARG A 250 250 PRO F Protein S 3 FT #SUB 215 215 ARG A 274 274 TYR F Protein S 4 FT #SUB 218 218 ALA A 248 248 SER F Protein S 2 FT #SUB 221 221 LYS A 222 222 ASP F Protein S 1 FT #SUB 233 233 TRP A 299 299 ARG F Protein S 4 FT #SUB 236 236 ASP A 298 298 HIS F Protein S 1 FT #SUB 236 236 ASP A 299 299 ARG F Protein S 2 FT #SUB 239 239 SER A 298 298 HIS F Protein S 1 FT #SUB 242 242 ARG A 245 245 ARG F Protein S 1 FT #SUB 242 242 ARG A 268 268 ASP F Protein S 1 FT #SUB 242 242 ARG A 270 270 GLY F Protein S 5 FT #SUB 246 246 ASN A 244 244 ALA F Protein S 1 FT #SUB 246 246 ASN A 247 247 THR F Protein S 2 FT #SUB 246 246 ASN A 248 248 SER F Protein S 3 FT #HET 22 22 ASP A 10 410 0YR A S 9 FT #HET 25 25 HIS A 10 410 0YR A S 3 FT #HET 30 30 TRP A 10 410 0YR A S 2 FT #HET 52 52 HIS A 10 410 0YR A S 7 FT #HET 54 54 HIS A 8 408 GOL A S 6 FT #HET 90 90 ARG A 9 409 GOL A S 7 FT #HET 96 96 TRP A 38 411 0YR D S 3 FT #HET 97 97 VAL A 3 403 CL A B 1 FT #HET 98 98 GLY A 3 403 CL A B 1 FT #HET 100 100 ALA A 3 403 CL A B 2 FT #HET 101 101 GLY A 3 403 CL A B 1 FT #HET 101 101 GLY A 32 405 CL D B 2 FT #HET 102 102 ILE A 3 403 CL A B 2 FT #HET 102 102 ILE A 32 405 CL D A 2 FT #HET 103 103 THR A 3 403 CL A A 5 FT #HET 134 134 ARG A 7 407 GOL A S 5 FT #HET 135 135 THR A 7 407 GOL A S 3 FT #HET 137 137 GLY A 7 407 GOL A B 3 FT #HET 138 138 VAL A 7 407 GOL A B 4 FT #HET 139 139 GLU A 7 407 GOL A A 7 FT #HET 147 147 TRP A 10 410 0YR A S 1 FT #HET 172 172 LYS A 5 405 MG A S 1 FT #HET 172 172 LYS A 10 410 0YR A S 3 FT #HET 174 174 LYS A 10 410 0YR A S 7 FT #HET 180 180 PRO A 6 406 GOL A S 5 FT #HET 181 181 ASN A 6 406 GOL A S 6 FT #HET 184 184 ILE A 6 406 GOL A S 1 FT #HET 203 203 ASP A 5 405 MG A S 3 FT #HET 203 203 ASP A 10 410 0YR A S 5 FT #HET 205 205 ASN A 5 405 MG A S 1 FT #HET 205 205 ASN A 10 410 0YR A S 8 FT #HET 215 215 ARG A 6 406 GOL A A 14 FT #HET 216 216 PHE A 6 406 GOL A B 2 FT #HET 219 219 ALA A 6 406 GOL A S 2 FT #HET 226 226 TYR A 2 402 CL A S 3 FT #HET 229 229 GLU A 5 405 MG A S 4 FT #HET 229 229 GLU A 10 410 0YR A S 2 FT #HET 233 233 TRP A 37 410 GOL D S 6 FT #HET 255 255 GLU A 5 405 MG A S 3 FT #HET 255 255 GLU A 10 410 0YR A S 10 FT #HET 268 268 ASP A 1 401 CA A S 3 FT #HET 274 274 TYR A 2 402 CL A S 1 FT #HET 298 298 HIS A 1 401 CA A S 3 FT #HET 305 305 HIS A 10 410 0YR A S 9 FT #HET 309 309 MET A 4 404 CL A S 1 FT #HET 324 324 THR A 2 402 CL A S 2 FT #HET 324 324 THR A 7 407 GOL A B 7 FT #HET 325 325 ILE A 7 407 GOL A A 3 FT #HET 327 327 GLU A 10 410 0YR A S 4 FT #HET 329 329 ILE A 4 404 CL A B 2 FT #HET 330 330 PRO A 4 404 CL A B 3 FT #HET 331 331 TRP A 4 404 CL A B 2 FT #HET 332 332 ILE A 4 404 CL A A 4 FT #HET 333 333 LYS A 4 404 CL A A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19B STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 77 77 ASP B 128 128 HIS C Protein S 1 FT #SUB 79 79 SER B 128 128 HIS C Protein S 2 FT #SUB 79 79 SER B 131 131 GLY C Protein B 1 FT #SUB 80 80 ASP B 128 128 HIS C Protein S 2 FT #SUB 80 80 ASP B 131 131 GLY C Protein A 5 FT #SUB 80 80 ASP B 132 132 GLY C Protein S 1 FT #SUB 81 81 HIS B 130 130 LEU C Protein S 2 FT #SUB 81 81 HIS B 131 131 GLY C Protein A 4 FT #SUB 82 82 SER B 130 130 LEU C Protein S 1 FT #SUB 82 82 SER B 131 131 GLY C Protein A 8 FT #SUB 82 82 SER B 319 319 TRP C Protein S 3 FT #SUB 83 83 ARG B 131 131 GLY C Protein B 1 FT #SUB 83 83 ARG B 133 133 ALA C Protein S 3 FT #SUB 90 90 ARG B 299 299 ARG C Protein S 1 FT #SUB 118 118 LYS B 128 128 HIS C Protein S 1 FT #SUB 118 118 LYS B 129 129 TYR C Protein S 2 FT #SUB 128 128 HIS B 77 77 ASP C Protein S 1 FT #SUB 128 128 HIS B 79 79 SER C Protein S 2 FT #SUB 128 128 HIS B 80 80 ASP C Protein S 2 FT #SUB 129 129 TYR B 129 129 TYR C Protein S 6 FT #SUB 130 130 LEU B 81 81 HIS C Protein B 2 FT #SUB 130 130 LEU B 82 82 SER C Protein B 1 FT #SUB 131 131 GLY B 79 79 SER C Protein B 1 FT #SUB 131 131 GLY B 80 80 ASP C Protein B 5 FT #SUB 131 131 GLY B 81 81 HIS C Protein B 4 FT #SUB 131 131 GLY B 82 82 SER C Protein B 8 FT #SUB 131 131 GLY B 83 83 ARG C Protein B 1 FT #SUB 132 132 GLY B 80 80 ASP C Protein B 1 FT #SUB 133 133 ALA B 83 83 ARG C Protein B 3 FT #SUB 260 260 VAL B 297 297 ALA C Protein S 2 FT #SUB 260 260 VAL B 299 299 ARG C Protein S 1 FT #SUB 261 261 ASP B 299 299 ARG C Protein S 11 FT #SUB 264 264 ARG B 297 297 ALA C Protein S 4 FT #SUB 264 264 ARG B 298 298 HIS C Protein S 12 FT #SUB 268 268 ASP B 268 268 ASP C Protein S 1 FT #SUB 268 268 ASP B 298 298 HIS C Protein S 2 FT #SUB 289 289 ILE B 293 293 ASP C Protein B 1 FT #SUB 290 290 GLN B 293 293 ASP C Protein A 4 FT #SUB 290 290 GLN B 296 296 LEU C Protein S 2 FT #SUB 293 293 ASP B 289 289 ILE C Protein S 1 FT #SUB 293 293 ASP B 290 290 GLN C Protein S 4 FT #SUB 293 293 ASP B 293 293 ASP C Protein S 6 FT #SUB 294 294 LEU B 294 294 LEU C Protein S 1 FT #SUB 294 294 LEU B 297 297 ALA C Protein S 1 FT #SUB 296 296 LEU B 260 260 VAL C Protein S 1 FT #SUB 296 296 LEU B 290 290 GLN C Protein S 3 FT #SUB 297 297 ALA B 260 260 VAL C Protein A 2 FT #SUB 297 297 ALA B 264 264 ARG C Protein B 4 FT #SUB 297 297 ALA B 294 294 LEU C Protein S 1 FT #SUB 298 298 HIS B 264 264 ARG C Protein A 12 FT #SUB 298 298 HIS B 268 268 ASP C Protein S 3 FT #SUB 299 299 ARG B 90 90 ARG C Protein S 1 FT #SUB 299 299 ARG B 260 260 VAL C Protein S 1 FT #SUB 299 299 ARG B 261 261 ASP C Protein S 10 FT #SUB 319 319 TRP B 82 82 SER C Protein S 3 FT #SUB 181 181 ASN B 224 224 ASP E Protein S 1 FT #SUB 209 209 ASP B 301 301 PRO E Protein S 3 FT #SUB 211 211 PRO B 250 250 PRO E Protein A 3 FT #SUB 211 211 PRO B 273 273 ALA E Protein S 2 FT #SUB 211 211 PRO B 274 274 TYR E Protein S 7 FT #SUB 212 212 THR B 274 274 TYR E Protein S 1 FT #SUB 214 214 GLN B 247 247 THR E Protein S 1 FT #SUB 214 214 GLN B 248 248 SER E Protein A 5 FT #SUB 215 215 ARG B 225 225 ILE E Protein S 1 FT #SUB 215 215 ARG B 226 226 TYR E Protein S 16 FT #SUB 215 215 ARG B 250 250 PRO E Protein S 2 FT #SUB 215 215 ARG B 274 274 TYR E Protein S 4 FT #SUB 218 218 ALA B 248 248 SER E Protein S 1 FT #SUB 233 233 TRP B 299 299 ARG E Protein S 3 FT #SUB 236 236 ASP B 298 298 HIS E Protein S 1 FT #SUB 236 236 ASP B 299 299 ARG E Protein S 2 FT #SUB 239 239 SER B 298 298 HIS E Protein S 1 FT #SUB 242 242 ARG B 245 245 ARG E Protein S 2 FT #SUB 242 242 ARG B 268 268 ASP E Protein S 1 FT #SUB 242 242 ARG B 270 270 GLY E Protein S 6 FT #SUB 246 246 ASN B 244 244 ALA E Protein S 1 FT #SUB 246 246 ASN B 247 247 THR E Protein S 3 FT #SUB 246 246 ASN B 248 248 SER E Protein S 2 FT #SUB 24 24 THR B 92 92 PRO G Protein B 2 FT #SUB 25 25 HIS B 92 92 PRO G Protein S 5 FT #SUB 25 25 HIS B 96 96 TRP G Protein S 2 FT #SUB 30 30 TRP B 96 96 TRP G Protein S 1 FT #SUB 50 50 GLY B 96 96 TRP G Protein B 4 FT #SUB 51 51 THR B 96 96 TRP G Protein B 2 FT #SUB 52 52 HIS B 96 96 TRP G Protein S 9 FT #SUB 54 54 HIS B 93 93 SER G Protein S 4 FT #SUB 54 54 HIS B 94 94 LEU G Protein S 2 FT #SUB 56 56 PRO B 67 67 ASP G Protein S 4 FT #SUB 56 56 PRO B 68 68 CYS G Protein A 2 FT #SUB 57 57 SER B 68 68 CYS G Protein A 3 FT #SUB 57 57 SER B 94 94 LEU G Protein S 2 FT #SUB 60 60 LEU B 60 60 LEU G Protein A 2 FT #SUB 60 60 LEU B 63 63 SER G Protein S 2 FT #SUB 60 60 LEU B 64 64 CYS G Protein S 2 FT #SUB 63 63 SER B 60 60 LEU G Protein S 1 FT #SUB 64 64 CYS B 60 60 LEU G Protein A 2 FT #SUB 67 67 ASP B 56 56 PRO G Protein A 4 FT #SUB 68 68 CYS B 54 54 HIS G Protein S 1 FT #SUB 68 68 CYS B 56 56 PRO G Protein S 2 FT #SUB 68 68 CYS B 57 57 SER G Protein S 1 FT #SUB 90 90 ARG B 233 233 TRP G Protein S 1 FT #SUB 92 92 PRO B 24 24 THR G Protein S 2 FT #SUB 92 92 PRO B 25 25 HIS G Protein A 5 FT #SUB 93 93 SER B 54 54 HIS G Protein S 4 FT #SUB 94 94 LEU B 54 54 HIS G Protein S 2 FT #SUB 94 94 LEU B 57 57 SER G Protein S 2 FT #SUB 95 95 GLN B 233 233 TRP G Protein S 2 FT #SUB 95 95 GLN B 234 234 TYR G Protein S 2 FT #SUB 96 96 TRP B 25 25 HIS G Protein S 1 FT #SUB 96 96 TRP B 50 50 GLY G Protein S 4 FT #SUB 96 96 TRP B 51 51 THR G Protein S 2 FT #SUB 96 96 TRP B 52 52 HIS G Protein S 8 FT #SUB 96 96 TRP B 255 255 GLU G Protein S 2 FT #SUB 96 96 TRP B 256 256 GLN G Protein S 3 FT #SUB 96 96 TRP B 281 281 ARG G Protein A 9 FT #SUB 97 97 VAL B 57 57 SER G Protein S 1 FT #SUB 97 97 VAL B 101 101 GLY G Protein B 1 FT #SUB 97 97 VAL B 102 102 ILE G Protein A 3 FT #SUB 97 97 VAL B 105 105 LEU G Protein A 3 FT #SUB 97 97 VAL B 258 258 TYR G Protein B 2 FT #SUB 98 98 GLY B 258 258 TYR G Protein B 6 FT #SUB 99 99 ARG B 234 234 TYR G Protein S 1 FT #SUB 99 99 ARG B 235 235 ASP G Protein S 9 FT #SUB 99 99 ARG B 256 256 GLN G Protein S 8 FT #SUB 99 99 ARG B 258 258 TYR G Protein S 1 FT #SUB 100 100 ALA B 100 100 ALA G Protein S 1 FT #SUB 100 100 ALA B 101 101 GLY G Protein B 1 FT #SUB 101 101 GLY B 97 97 VAL G Protein B 1 FT #SUB 101 101 GLY B 100 100 ALA G Protein B 1 FT #SUB 102 102 ILE B 97 97 VAL G Protein A 5 FT #SUB 102 102 ILE B 102 102 ILE G Protein S 3 FT #SUB 105 105 LEU B 97 97 VAL G Protein S 3 FT #SUB 233 233 TRP B 90 90 ARG G Protein S 2 FT #SUB 233 233 TRP B 95 95 GLN G Protein S 2 FT #SUB 233 233 TRP B 261 261 ASP G Protein S 6 FT #SUB 234 234 TYR B 95 95 GLN G Protein S 2 FT #SUB 234 234 TYR B 99 99 ARG G Protein S 1 FT #SUB 235 235 ASP B 99 99 ARG G Protein S 10 FT #SUB 235 235 ASP B 261 261 ASP G Protein A 3 FT #SUB 236 236 ASP B 264 264 ARG G Protein S 3 FT #SUB 238 238 THR B 264 264 ARG G Protein S 4 FT #SUB 255 255 GLU B 96 96 TRP G Protein S 2 FT #SUB 256 256 GLN B 96 96 TRP G Protein S 3 FT #SUB 256 256 GLN B 99 99 ARG G Protein A 7 FT #SUB 258 258 TYR B 97 97 VAL G Protein S 2 FT #SUB 258 258 TYR B 98 98 GLY G Protein S 6 FT #SUB 258 258 TYR B 99 99 ARG G Protein S 1 FT #SUB 261 261 ASP B 233 233 TRP G Protein S 5 FT #SUB 261 261 ASP B 235 235 ASP G Protein S 3 FT #SUB 264 264 ARG B 236 236 ASP G Protein S 3 FT #SUB 264 264 ARG B 238 238 THR G Protein S 4 FT #SUB 281 281 ARG B 96 96 TRP G Protein S 8 FT #SUB 222 222 ASP B 221 221 LYS M Protein S 1 FT #SUB 224 224 ASP B 181 181 ASN M Protein S 1 FT #SUB 225 225 ILE B 215 215 ARG M Protein B 1 FT #SUB 226 226 TYR B 215 215 ARG M Protein A 14 FT #SUB 244 244 ALA B 246 246 ASN M Protein B 1 FT #SUB 245 245 ARG B 242 242 ARG M Protein S 2 FT #SUB 247 247 THR B 214 214 GLN M Protein B 1 FT #SUB 247 247 THR B 246 246 ASN M Protein B 2 FT #SUB 248 248 SER B 214 214 GLN M Protein A 5 FT #SUB 248 248 SER B 218 218 ALA M Protein S 2 FT #SUB 248 248 SER B 246 246 ASN M Protein A 2 FT #SUB 250 250 PRO B 211 211 PRO M Protein S 4 FT #SUB 250 250 PRO B 215 215 ARG M Protein S 4 FT #SUB 268 268 ASP B 242 242 ARG M Protein B 1 FT #SUB 270 270 GLY B 242 242 ARG M Protein B 6 FT #SUB 273 273 ALA B 211 211 PRO M Protein S 1 FT #SUB 274 274 TYR B 211 211 PRO M Protein S 7 FT #SUB 274 274 TYR B 212 212 THR M Protein S 1 FT #SUB 274 274 TYR B 215 215 ARG M Protein S 4 FT #SUB 298 298 HIS B 236 236 ASP M Protein B 1 FT #SUB 298 298 HIS B 239 239 SER M Protein B 1 FT #SUB 299 299 ARG B 209 209 ASP M Protein B 1 FT #SUB 299 299 ARG B 233 233 TRP M Protein S 4 FT #SUB 299 299 ARG B 236 236 ASP M Protein S 2 FT #SUB 301 301 PRO B 209 209 ASP M Protein S 4 FT #HET 22 22 ASP B 19 409 0YR B S 8 FT #HET 25 25 HIS B 19 409 0YR B S 3 FT #HET 30 30 TRP B 19 409 0YR B S 2 FT #HET 52 52 HIS B 19 409 0YR B S 5 FT #HET 54 54 HIS B 18 408 GOL B S 6 FT #HET 90 90 ARG B 17 407 GOL B S 7 FT #HET 96 96 TRP B 63 409 0YR G S 3 FT #HET 97 97 VAL B 13 403 CL B B 1 FT #HET 98 98 GLY B 13 403 CL B B 1 FT #HET 100 100 ALA B 13 403 CL B B 2 FT #HET 101 101 GLY B 13 403 CL B B 1 FT #HET 101 101 GLY B 57 403 CL G B 2 FT #HET 102 102 ILE B 13 403 CL B B 1 FT #HET 102 102 ILE B 57 403 CL G A 2 FT #HET 103 103 THR B 13 403 CL B A 4 FT #HET 147 147 TRP B 19 409 0YR B S 1 FT #HET 172 172 LYS B 15 405 MG B S 1 FT #HET 172 172 LYS B 19 409 0YR B S 3 FT #HET 174 174 LYS B 19 409 0YR B S 7 FT #HET 180 180 PRO B 16 406 GOL B S 5 FT #HET 181 181 ASN B 16 406 GOL B S 5 FT #HET 184 184 ILE B 16 406 GOL B S 1 FT #HET 203 203 ASP B 15 405 MG B S 3 FT #HET 203 203 ASP B 19 409 0YR B S 4 FT #HET 205 205 ASN B 19 409 0YR B S 8 FT #HET 215 215 ARG B 16 406 GOL B A 16 FT #HET 216 216 PHE B 16 406 GOL B B 2 FT #HET 219 219 ALA B 16 406 GOL B S 2 FT #HET 224 224 ASP B 100 406 GOL M S 5 FT #HET 226 226 TYR B 12 402 CL B S 3 FT #HET 229 229 GLU B 15 405 MG B S 3 FT #HET 229 229 GLU B 19 409 0YR B S 2 FT #HET 233 233 TRP B 62 408 GOL G S 6 FT #HET 255 255 GLU B 15 405 MG B S 3 FT #HET 255 255 GLU B 19 409 0YR B S 11 FT #HET 268 268 ASP B 11 401 CA B S 3 FT #HET 274 274 TYR B 12 402 CL B S 1 FT #HET 298 298 HIS B 11 401 CA B S 2 FT #HET 299 299 ARG B 25 406 GOL C S 4 FT #HET 305 305 HIS B 19 409 0YR B S 9 FT #HET 309 309 MET B 14 404 CL B S 1 FT #HET 324 324 THR B 12 402 CL B S 3 FT #HET 325 325 ILE B 12 402 CL B S 1 FT #HET 327 327 GLU B 19 409 0YR B S 4 FT #HET 329 329 ILE B 14 404 CL B B 2 FT #HET 330 330 PRO B 14 404 CL B B 3 FT #HET 331 331 TRP B 14 404 CL B B 3 FT #HET 332 332 ILE B 14 404 CL B A 4 FT #HET 333 333 LYS B 14 404 CL B A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19C STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 77 77 ASP C 128 128 HIS B Protein S 1 FT #SUB 79 79 SER C 128 128 HIS B Protein S 2 FT #SUB 79 79 SER C 131 131 GLY B Protein B 1 FT #SUB 80 80 ASP C 128 128 HIS B Protein S 2 FT #SUB 80 80 ASP C 131 131 GLY B Protein A 5 FT #SUB 80 80 ASP C 132 132 GLY B Protein S 1 FT #SUB 81 81 HIS C 130 130 LEU B Protein S 2 FT #SUB 81 81 HIS C 131 131 GLY B Protein A 4 FT #SUB 82 82 SER C 130 130 LEU B Protein S 1 FT #SUB 82 82 SER C 131 131 GLY B Protein A 8 FT #SUB 82 82 SER C 319 319 TRP B Protein S 3 FT #SUB 83 83 ARG C 131 131 GLY B Protein B 1 FT #SUB 83 83 ARG C 133 133 ALA B Protein S 3 FT #SUB 90 90 ARG C 299 299 ARG B Protein S 1 FT #SUB 128 128 HIS C 77 77 ASP B Protein S 1 FT #SUB 128 128 HIS C 79 79 SER B Protein S 2 FT #SUB 128 128 HIS C 80 80 ASP B Protein S 2 FT #SUB 128 128 HIS C 118 118 LYS B Protein B 1 FT #SUB 129 129 TYR C 118 118 LYS B Protein B 2 FT #SUB 129 129 TYR C 129 129 TYR B Protein S 6 FT #SUB 130 130 LEU C 81 81 HIS B Protein B 2 FT #SUB 130 130 LEU C 82 82 SER B Protein B 1 FT #SUB 131 131 GLY C 79 79 SER B Protein B 1 FT #SUB 131 131 GLY C 80 80 ASP B Protein B 5 FT #SUB 131 131 GLY C 81 81 HIS B Protein B 4 FT #SUB 131 131 GLY C 82 82 SER B Protein B 8 FT #SUB 131 131 GLY C 83 83 ARG B Protein B 1 FT #SUB 132 132 GLY C 80 80 ASP B Protein B 1 FT #SUB 133 133 ALA C 83 83 ARG B Protein B 3 FT #SUB 260 260 VAL C 296 296 LEU B Protein S 1 FT #SUB 260 260 VAL C 297 297 ALA B Protein S 2 FT #SUB 260 260 VAL C 299 299 ARG B Protein S 1 FT #SUB 261 261 ASP C 299 299 ARG B Protein S 10 FT #SUB 264 264 ARG C 297 297 ALA B Protein S 4 FT #SUB 264 264 ARG C 298 298 HIS B Protein S 12 FT #SUB 268 268 ASP C 268 268 ASP B Protein S 1 FT #SUB 268 268 ASP C 298 298 HIS B Protein S 3 FT #SUB 289 289 ILE C 293 293 ASP B Protein B 1 FT #SUB 290 290 GLN C 293 293 ASP B Protein A 4 FT #SUB 290 290 GLN C 296 296 LEU B Protein S 3 FT #SUB 293 293 ASP C 289 289 ILE B Protein S 1 FT #SUB 293 293 ASP C 290 290 GLN B Protein S 4 FT #SUB 293 293 ASP C 293 293 ASP B Protein S 6 FT #SUB 294 294 LEU C 294 294 LEU B Protein S 1 FT #SUB 294 294 LEU C 297 297 ALA B Protein S 1 FT #SUB 296 296 LEU C 290 290 GLN B Protein S 2 FT #SUB 297 297 ALA C 260 260 VAL B Protein A 2 FT #SUB 297 297 ALA C 264 264 ARG B Protein B 4 FT #SUB 297 297 ALA C 294 294 LEU B Protein S 1 FT #SUB 298 298 HIS C 264 264 ARG B Protein A 12 FT #SUB 298 298 HIS C 268 268 ASP B Protein S 2 FT #SUB 299 299 ARG C 90 90 ARG B Protein S 1 FT #SUB 299 299 ARG C 260 260 VAL B Protein S 1 FT #SUB 299 299 ARG C 261 261 ASP B Protein S 11 FT #SUB 319 319 TRP C 82 82 SER B Protein S 3 FT #SUB 222 222 ASP C 221 221 LYS G Protein S 1 FT #SUB 224 224 ASP C 181 181 ASN G Protein S 1 FT #SUB 225 225 ILE C 215 215 ARG G Protein B 1 FT #SUB 226 226 TYR C 215 215 ARG G Protein A 16 FT #SUB 244 244 ALA C 246 246 ASN G Protein B 1 FT #SUB 247 247 THR C 214 214 GLN G Protein B 1 FT #SUB 247 247 THR C 246 246 ASN G Protein B 3 FT #SUB 248 248 SER C 214 214 GLN G Protein A 5 FT #SUB 248 248 SER C 218 218 ALA G Protein S 2 FT #SUB 248 248 SER C 246 246 ASN G Protein A 3 FT #SUB 250 250 PRO C 211 211 PRO G Protein S 4 FT #SUB 250 250 PRO C 215 215 ARG G Protein S 4 FT #SUB 268 268 ASP C 242 242 ARG G Protein B 1 FT #SUB 270 270 GLY C 242 242 ARG G Protein B 6 FT #SUB 273 273 ALA C 211 211 PRO G Protein S 1 FT #SUB 274 274 TYR C 211 211 PRO G Protein S 7 FT #SUB 274 274 TYR C 212 212 THR G Protein S 1 FT #SUB 274 274 TYR C 215 215 ARG G Protein S 4 FT #SUB 298 298 HIS C 236 236 ASP G Protein B 1 FT #SUB 298 298 HIS C 239 239 SER G Protein B 1 FT #SUB 299 299 ARG C 209 209 ASP G Protein B 1 FT #SUB 299 299 ARG C 233 233 TRP G Protein S 3 FT #SUB 299 299 ARG C 236 236 ASP G Protein S 2 FT #SUB 301 301 PRO C 209 209 ASP G Protein S 3 FT #SUB 301 301 PRO C 211 211 PRO G Protein S 1 FT #SUB 181 181 ASN C 224 224 ASP L Protein S 1 FT #SUB 209 209 ASP C 301 301 PRO L Protein S 3 FT #SUB 211 211 PRO C 250 250 PRO L Protein A 4 FT #SUB 211 211 PRO C 273 273 ALA L Protein S 1 FT #SUB 211 211 PRO C 274 274 TYR L Protein S 6 FT #SUB 212 212 THR C 274 274 TYR L Protein S 1 FT #SUB 214 214 GLN C 247 247 THR L Protein S 1 FT #SUB 214 214 GLN C 248 248 SER L Protein A 5 FT #SUB 215 215 ARG C 225 225 ILE L Protein S 1 FT #SUB 215 215 ARG C 226 226 TYR L Protein S 16 FT #SUB 215 215 ARG C 250 250 PRO L Protein S 4 FT #SUB 215 215 ARG C 274 274 TYR L Protein S 4 FT #SUB 218 218 ALA C 248 248 SER L Protein S 2 FT #SUB 221 221 LYS C 222 222 ASP L Protein S 1 FT #SUB 233 233 TRP C 299 299 ARG L Protein S 3 FT #SUB 236 236 ASP C 298 298 HIS L Protein S 1 FT #SUB 236 236 ASP C 299 299 ARG L Protein S 2 FT #SUB 239 239 SER C 298 298 HIS L Protein S 1 FT #SUB 242 242 ARG C 268 268 ASP L Protein S 1 FT #SUB 242 242 ARG C 270 270 GLY L Protein S 4 FT #SUB 246 246 ASN C 244 244 ALA L Protein S 1 FT #SUB 246 246 ASN C 247 247 THR L Protein S 3 FT #SUB 246 246 ASN C 248 248 SER L Protein S 2 FT #SUB 24 24 THR C 92 92 PRO M Protein B 2 FT #SUB 25 25 HIS C 92 92 PRO M Protein S 6 FT #SUB 25 25 HIS C 96 96 TRP M Protein S 1 FT #SUB 30 30 TRP C 96 96 TRP M Protein S 1 FT #SUB 50 50 GLY C 96 96 TRP M Protein B 4 FT #SUB 51 51 THR C 96 96 TRP M Protein B 2 FT #SUB 52 52 HIS C 96 96 TRP M Protein A 13 FT #SUB 54 54 HIS C 93 93 SER M Protein S 4 FT #SUB 54 54 HIS C 94 94 LEU M Protein S 2 FT #SUB 56 56 PRO C 67 67 ASP M Protein S 3 FT #SUB 56 56 PRO C 68 68 CYS M Protein A 2 FT #SUB 57 57 SER C 68 68 CYS M Protein B 1 FT #SUB 57 57 SER C 94 94 LEU M Protein S 2 FT #SUB 60 60 LEU C 60 60 LEU M Protein A 2 FT #SUB 60 60 LEU C 63 63 SER M Protein S 1 FT #SUB 60 60 LEU C 64 64 CYS M Protein S 2 FT #SUB 63 63 SER C 60 60 LEU M Protein S 1 FT #SUB 64 64 CYS C 60 60 LEU M Protein A 2 FT #SUB 67 67 ASP C 56 56 PRO M Protein A 4 FT #SUB 68 68 CYS C 54 54 HIS M Protein S 1 FT #SUB 68 68 CYS C 56 56 PRO M Protein S 2 FT #SUB 68 68 CYS C 57 57 SER M Protein S 2 FT #SUB 90 90 ARG C 233 233 TRP M Protein S 4 FT #SUB 92 92 PRO C 24 24 THR M Protein S 2 FT #SUB 92 92 PRO C 25 25 HIS M Protein A 7 FT #SUB 93 93 SER C 54 54 HIS M Protein S 5 FT #SUB 94 94 LEU C 54 54 HIS M Protein S 2 FT #SUB 94 94 LEU C 57 57 SER M Protein S 2 FT #SUB 95 95 GLN C 233 233 TRP M Protein S 1 FT #SUB 95 95 GLN C 234 234 TYR M Protein S 2 FT #SUB 96 96 TRP C 25 25 HIS M Protein S 1 FT #SUB 96 96 TRP C 50 50 GLY M Protein S 4 FT #SUB 96 96 TRP C 51 51 THR M Protein S 2 FT #SUB 96 96 TRP C 52 52 HIS M Protein S 9 FT #SUB 96 96 TRP C 255 255 GLU M Protein S 1 FT #SUB 96 96 TRP C 256 256 GLN M Protein S 3 FT #SUB 96 96 TRP C 281 281 ARG M Protein A 8 FT #SUB 97 97 VAL C 101 101 GLY M Protein B 1 FT #SUB 97 97 VAL C 102 102 ILE M Protein B 2 FT #SUB 97 97 VAL C 105 105 LEU M Protein A 3 FT #SUB 97 97 VAL C 258 258 TYR M Protein B 3 FT #SUB 98 98 GLY C 258 258 TYR M Protein B 6 FT #SUB 99 99 ARG C 234 234 TYR M Protein S 1 FT #SUB 99 99 ARG C 235 235 ASP M Protein S 9 FT #SUB 99 99 ARG C 256 256 GLN M Protein S 8 FT #SUB 99 99 ARG C 258 258 TYR M Protein S 1 FT #SUB 100 100 ALA C 100 100 ALA M Protein S 1 FT #SUB 100 100 ALA C 101 101 GLY M Protein B 1 FT #SUB 101 101 GLY C 97 97 VAL M Protein B 1 FT #SUB 101 101 GLY C 100 100 ALA M Protein B 1 FT #SUB 102 102 ILE C 97 97 VAL M Protein A 5 FT #SUB 102 102 ILE C 102 102 ILE M Protein S 3 FT #SUB 105 105 LEU C 97 97 VAL M Protein S 3 FT #SUB 233 233 TRP C 90 90 ARG M Protein S 2 FT #SUB 233 233 TRP C 95 95 GLN M Protein S 2 FT #SUB 233 233 TRP C 261 261 ASP M Protein S 6 FT #SUB 234 234 TYR C 95 95 GLN M Protein S 2 FT #SUB 234 234 TYR C 99 99 ARG M Protein S 1 FT #SUB 235 235 ASP C 99 99 ARG M Protein S 10 FT #SUB 235 235 ASP C 261 261 ASP M Protein A 3 FT #SUB 236 236 ASP C 264 264 ARG M Protein S 3 FT #SUB 238 238 THR C 264 264 ARG M Protein S 4 FT #SUB 255 255 GLU C 96 96 TRP M Protein S 1 FT #SUB 256 256 GLN C 96 96 TRP M Protein S 3 FT #SUB 256 256 GLN C 99 99 ARG M Protein A 6 FT #SUB 258 258 TYR C 97 97 VAL M Protein S 3 FT #SUB 258 258 TYR C 98 98 GLY M Protein S 6 FT #SUB 258 258 TYR C 99 99 ARG M Protein S 1 FT #SUB 261 261 ASP C 233 233 TRP M Protein S 5 FT #SUB 261 261 ASP C 235 235 ASP M Protein S 3 FT #SUB 264 264 ARG C 236 236 ASP M Protein S 3 FT #SUB 264 264 ARG C 238 238 THR M Protein S 4 FT #SUB 281 281 ARG C 96 96 TRP M Protein S 8 FT #HET 22 22 ASP C 27 408 0YR C S 8 FT #HET 25 25 HIS C 27 408 0YR C S 3 FT #HET 30 30 TRP C 27 408 0YR C S 2 FT #HET 52 52 HIS C 27 408 0YR C S 8 FT #HET 90 90 ARG C 25 406 GOL C S 6 FT #HET 96 96 TRP C 101 407 0YR M S 3 FT #HET 97 97 VAL C 22 403 CL C B 1 FT #HET 98 98 GLY C 22 403 CL C B 1 FT #HET 100 100 ALA C 22 403 CL C B 2 FT #HET 101 101 GLY C 22 403 CL C B 1 FT #HET 102 102 ILE C 22 403 CL C B 3 FT #HET 103 103 THR C 22 403 CL C A 5 FT #HET 134 134 ARG C 26 407 GOL C S 4 FT #HET 137 137 GLY C 26 407 GOL C B 2 FT #HET 138 138 VAL C 26 407 GOL C B 2 FT #HET 139 139 GLU C 26 407 GOL C A 6 FT #HET 147 147 TRP C 27 408 0YR C S 2 FT #HET 172 172 LYS C 23 404 MG C S 1 FT #HET 172 172 LYS C 27 408 0YR C S 3 FT #HET 174 174 LYS C 27 408 0YR C S 8 FT #HET 180 180 PRO C 24 405 GOL C S 5 FT #HET 181 181 ASN C 24 405 GOL C S 7 FT #HET 184 184 ILE C 24 405 GOL C S 1 FT #HET 203 203 ASP C 23 404 MG C S 3 FT #HET 203 203 ASP C 27 408 0YR C S 4 FT #HET 205 205 ASN C 23 404 MG C S 1 FT #HET 205 205 ASN C 27 408 0YR C S 7 FT #HET 215 215 ARG C 24 405 GOL C A 12 FT #HET 216 216 PHE C 24 405 GOL C B 1 FT #HET 219 219 ALA C 24 405 GOL C S 2 FT #HET 224 224 ASP C 60 406 GOL G S 5 FT #HET 226 226 TYR C 20 401 CL C S 3 FT #HET 229 229 GLU C 23 404 MG C S 3 FT #HET 229 229 GLU C 27 408 0YR C S 2 FT #HET 233 233 TRP C 93 406 GOL L S 5 FT #HET 255 255 GLU C 23 404 MG C S 3 FT #HET 255 255 GLU C 27 408 0YR C S 10 FT #HET 268 268 ASP C 11 401 CA B S 3 FT #HET 274 274 TYR C 20 401 CL C S 1 FT #HET 298 298 HIS C 11 401 CA B S 2 FT #HET 299 299 ARG C 17 407 GOL B S 2 FT #HET 305 305 HIS C 27 408 0YR C S 9 FT #HET 309 309 MET C 21 402 CL C S 1 FT #HET 324 324 THR C 20 401 CL C S 2 FT #HET 324 324 THR C 26 407 GOL C A 8 FT #HET 325 325 ILE C 20 401 CL C S 1 FT #HET 325 325 ILE C 26 407 GOL C S 1 FT #HET 327 327 GLU C 27 408 0YR C S 4 FT #HET 329 329 ILE C 21 402 CL C B 2 FT #HET 330 330 PRO C 21 402 CL C B 3 FT #HET 331 331 TRP C 21 402 CL C B 3 FT #HET 332 332 ILE C 21 402 CL C A 4 FT #HET 333 333 LYS C 21 402 CL C A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19D STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 24 24 THR D 92 92 PRO A Protein B 2 FT #SUB 25 25 HIS D 92 92 PRO A Protein S 6 FT #SUB 25 25 HIS D 96 96 TRP A Protein S 2 FT #SUB 50 50 GLY D 96 96 TRP A Protein B 4 FT #SUB 51 51 THR D 96 96 TRP A Protein B 2 FT #SUB 52 52 HIS D 96 96 TRP A Protein A 13 FT #SUB 54 54 HIS D 93 93 SER A Protein S 5 FT #SUB 54 54 HIS D 94 94 LEU A Protein S 2 FT #SUB 56 56 PRO D 67 67 ASP A Protein S 4 FT #SUB 56 56 PRO D 68 68 CYS A Protein A 2 FT #SUB 57 57 SER D 68 68 CYS A Protein B 1 FT #SUB 57 57 SER D 94 94 LEU A Protein S 2 FT #SUB 60 60 LEU D 60 60 LEU A Protein A 2 FT #SUB 60 60 LEU D 63 63 SER A Protein S 1 FT #SUB 60 60 LEU D 64 64 CYS A Protein S 2 FT #SUB 63 63 SER D 60 60 LEU A Protein S 1 FT #SUB 64 64 CYS D 60 60 LEU A Protein A 2 FT #SUB 67 67 ASP D 56 56 PRO A Protein A 4 FT #SUB 68 68 CYS D 56 56 PRO A Protein S 2 FT #SUB 68 68 CYS D 57 57 SER A Protein S 2 FT #SUB 68 68 CYS D 60 60 LEU A Protein S 1 FT #SUB 90 90 ARG D 233 233 TRP A Protein S 3 FT #SUB 92 92 PRO D 24 24 THR A Protein S 2 FT #SUB 92 92 PRO D 25 25 HIS A Protein A 6 FT #SUB 93 93 SER D 54 54 HIS A Protein S 4 FT #SUB 94 94 LEU D 54 54 HIS A Protein S 2 FT #SUB 94 94 LEU D 57 57 SER A Protein S 2 FT #SUB 95 95 GLN D 24 24 THR A Protein S 1 FT #SUB 95 95 GLN D 233 233 TRP A Protein S 2 FT #SUB 95 95 GLN D 234 234 TYR A Protein S 2 FT #SUB 96 96 TRP D 25 25 HIS A Protein S 1 FT #SUB 96 96 TRP D 30 30 TRP A Protein S 1 FT #SUB 96 96 TRP D 50 50 GLY A Protein S 4 FT #SUB 96 96 TRP D 51 51 THR A Protein S 2 FT #SUB 96 96 TRP D 52 52 HIS A Protein S 11 FT #SUB 96 96 TRP D 255 255 GLU A Protein S 2 FT #SUB 96 96 TRP D 256 256 GLN A Protein S 3 FT #SUB 96 96 TRP D 281 281 ARG A Protein A 8 FT #SUB 97 97 VAL D 101 101 GLY A Protein B 1 FT #SUB 97 97 VAL D 102 102 ILE A Protein A 4 FT #SUB 97 97 VAL D 105 105 LEU A Protein A 3 FT #SUB 97 97 VAL D 258 258 TYR A Protein B 3 FT #SUB 98 98 GLY D 258 258 TYR A Protein B 6 FT #SUB 99 99 ARG D 233 233 TRP A Protein S 1 FT #SUB 99 99 ARG D 234 234 TYR A Protein S 1 FT #SUB 99 99 ARG D 235 235 ASP A Protein S 9 FT #SUB 99 99 ARG D 256 256 GLN A Protein S 7 FT #SUB 99 99 ARG D 258 258 TYR A Protein S 1 FT #SUB 100 100 ALA D 100 100 ALA A Protein S 1 FT #SUB 100 100 ALA D 101 101 GLY A Protein B 1 FT #SUB 101 101 GLY D 97 97 VAL A Protein B 1 FT #SUB 101 101 GLY D 100 100 ALA A Protein B 1 FT #SUB 102 102 ILE D 97 97 VAL A Protein A 3 FT #SUB 102 102 ILE D 102 102 ILE A Protein S 3 FT #SUB 105 105 LEU D 97 97 VAL A Protein S 3 FT #SUB 233 233 TRP D 90 90 ARG A Protein S 3 FT #SUB 233 233 TRP D 95 95 GLN A Protein S 2 FT #SUB 233 233 TRP D 261 261 ASP A Protein S 6 FT #SUB 234 234 TYR D 95 95 GLN A Protein S 2 FT #SUB 234 234 TYR D 99 99 ARG A Protein S 2 FT #SUB 235 235 ASP D 99 99 ARG A Protein S 9 FT #SUB 235 235 ASP D 261 261 ASP A Protein A 3 FT #SUB 236 236 ASP D 264 264 ARG A Protein S 3 FT #SUB 238 238 THR D 264 264 ARG A Protein S 4 FT #SUB 255 255 GLU D 96 96 TRP A Protein S 2 FT #SUB 256 256 GLN D 96 96 TRP A Protein S 3 FT #SUB 256 256 GLN D 99 99 ARG A Protein A 7 FT #SUB 258 258 TYR D 97 97 VAL A Protein S 3 FT #SUB 258 258 TYR D 98 98 GLY A Protein S 6 FT #SUB 258 258 TYR D 99 99 ARG A Protein S 1 FT #SUB 261 261 ASP D 233 233 TRP A Protein S 5 FT #SUB 261 261 ASP D 235 235 ASP A Protein S 3 FT #SUB 264 264 ARG D 236 236 ASP A Protein S 3 FT #SUB 264 264 ARG D 238 238 THR A Protein S 4 FT #SUB 281 281 ARG D 96 96 TRP A Protein S 8 FT #SUB 136 136 ALA D 362 362 GLU E Protein A 6 FT #SUB 343 343 ARG D 364 364 PHE E Protein S 2 FT #SUB 343 343 ARG D 368 368 GLY E Protein S 3 FT #SUB 343 343 ARG D 369 369 LYS E Protein S 1 FT #SUB 347 347 TYR D 365 365 THR E Protein B 1 FT #SUB 348 348 LYS D 365 365 THR E Protein A 2 FT #SUB 348 348 LYS D 366 366 ARG E Protein S 2 FT #SUB 349 349 ARG D 366 366 ARG E Protein S 1 FT #SUB 351 351 GLU D 366 366 ARG E Protein S 4 FT #SUB 77 77 ASP D 128 128 HIS F Protein S 1 FT #SUB 79 79 SER D 128 128 HIS F Protein S 2 FT #SUB 79 79 SER D 131 131 GLY F Protein B 1 FT #SUB 80 80 ASP D 128 128 HIS F Protein S 2 FT #SUB 80 80 ASP D 131 131 GLY F Protein A 6 FT #SUB 80 80 ASP D 132 132 GLY F Protein S 1 FT #SUB 81 81 HIS D 130 130 LEU F Protein S 2 FT #SUB 81 81 HIS D 131 131 GLY F Protein A 4 FT #SUB 82 82 SER D 130 130 LEU F Protein S 1 FT #SUB 82 82 SER D 131 131 GLY F Protein A 10 FT #SUB 82 82 SER D 319 319 TRP F Protein S 4 FT #SUB 83 83 ARG D 131 131 GLY F Protein B 1 FT #SUB 83 83 ARG D 133 133 ALA F Protein S 3 FT #SUB 90 90 ARG D 299 299 ARG F Protein S 1 FT #SUB 118 118 LYS D 129 129 TYR F Protein S 1 FT #SUB 128 128 HIS D 77 77 ASP F Protein S 1 FT #SUB 128 128 HIS D 79 79 SER F Protein S 1 FT #SUB 128 128 HIS D 80 80 ASP F Protein S 2 FT #SUB 128 128 HIS D 118 118 LYS F Protein B 1 FT #SUB 129 129 TYR D 118 118 LYS F Protein B 3 FT #SUB 129 129 TYR D 129 129 TYR F Protein S 6 FT #SUB 130 130 LEU D 81 81 HIS F Protein B 2 FT #SUB 130 130 LEU D 82 82 SER F Protein B 1 FT #SUB 131 131 GLY D 79 79 SER F Protein B 1 FT #SUB 131 131 GLY D 80 80 ASP F Protein B 6 FT #SUB 131 131 GLY D 81 81 HIS F Protein B 4 FT #SUB 131 131 GLY D 82 82 SER F Protein B 10 FT #SUB 131 131 GLY D 83 83 ARG F Protein B 1 FT #SUB 132 132 GLY D 80 80 ASP F Protein B 1 FT #SUB 133 133 ALA D 83 83 ARG F Protein B 3 FT #SUB 260 260 VAL D 296 296 LEU F Protein S 1 FT #SUB 260 260 VAL D 297 297 ALA F Protein S 1 FT #SUB 260 260 VAL D 299 299 ARG F Protein S 1 FT #SUB 261 261 ASP D 299 299 ARG F Protein S 11 FT #SUB 264 264 ARG D 297 297 ALA F Protein S 4 FT #SUB 264 264 ARG D 298 298 HIS F Protein S 12 FT #SUB 268 268 ASP D 268 268 ASP F Protein S 1 FT #SUB 268 268 ASP D 298 298 HIS F Protein S 2 FT #SUB 289 289 ILE D 293 293 ASP F Protein B 1 FT #SUB 290 290 GLN D 293 293 ASP F Protein A 4 FT #SUB 290 290 GLN D 296 296 LEU F Protein S 3 FT #SUB 293 293 ASP D 289 289 ILE F Protein S 1 FT #SUB 293 293 ASP D 290 290 GLN F Protein S 4 FT #SUB 293 293 ASP D 293 293 ASP F Protein S 6 FT #SUB 294 294 LEU D 294 294 LEU F Protein S 1 FT #SUB 294 294 LEU D 297 297 ALA F Protein S 1 FT #SUB 296 296 LEU D 260 260 VAL F Protein S 1 FT #SUB 296 296 LEU D 290 290 GLN F Protein S 2 FT #SUB 297 297 ALA D 260 260 VAL F Protein A 2 FT #SUB 297 297 ALA D 264 264 ARG F Protein B 4 FT #SUB 297 297 ALA D 294 294 LEU F Protein S 1 FT #SUB 298 298 HIS D 264 264 ARG F Protein A 12 FT #SUB 298 298 HIS D 268 268 ASP F Protein S 5 FT #SUB 299 299 ARG D 90 90 ARG F Protein S 1 FT #SUB 299 299 ARG D 260 260 VAL F Protein S 1 FT #SUB 299 299 ARG D 261 261 ASP F Protein S 10 FT #SUB 319 319 TRP D 82 82 SER F Protein S 4 FT #SUB 222 222 ASP D 221 221 LYS K Protein S 1 FT #SUB 224 224 ASP D 181 181 ASN K Protein S 1 FT #SUB 225 225 ILE D 215 215 ARG K Protein B 1 FT #SUB 226 226 TYR D 215 215 ARG K Protein A 17 FT #SUB 245 245 ARG D 242 242 ARG K Protein S 2 FT #SUB 247 247 THR D 214 214 GLN K Protein B 1 FT #SUB 247 247 THR D 246 246 ASN K Protein B 3 FT #SUB 248 248 SER D 214 214 GLN K Protein A 6 FT #SUB 248 248 SER D 218 218 ALA K Protein S 2 FT #SUB 248 248 SER D 246 246 ASN K Protein A 2 FT #SUB 250 250 PRO D 211 211 PRO K Protein S 4 FT #SUB 250 250 PRO D 215 215 ARG K Protein S 3 FT #SUB 268 268 ASP D 242 242 ARG K Protein B 1 FT #SUB 270 270 GLY D 242 242 ARG K Protein B 6 FT #SUB 273 273 ALA D 211 211 PRO K Protein S 1 FT #SUB 274 274 TYR D 211 211 PRO K Protein S 6 FT #SUB 274 274 TYR D 215 215 ARG K Protein S 4 FT #SUB 298 298 HIS D 236 236 ASP K Protein B 1 FT #SUB 298 298 HIS D 239 239 SER K Protein B 1 FT #SUB 299 299 ARG D 233 233 TRP K Protein S 3 FT #SUB 299 299 ARG D 236 236 ASP K Protein S 2 FT #SUB 301 301 PRO D 209 209 ASP K Protein S 3 FT #HET 22 22 ASP D 38 411 0YR D S 8 FT #HET 25 25 HIS D 38 411 0YR D S 3 FT #HET 30 30 TRP D 38 411 0YR D S 2 FT #HET 52 52 HIS D 38 411 0YR D S 6 FT #HET 68 68 CYS D 8 408 GOL A B 4 FT #HET 71 71 PRO D 8 408 GOL A S 1 FT #HET 72 72 LEU D 8 408 GOL A S 3 FT #HET 90 90 ARG D 37 410 GOL D S 8 FT #HET 91 91 TYR D 8 408 GOL A S 3 FT #HET 96 96 TRP D 10 410 0YR A S 4 FT #HET 97 97 VAL D 32 405 CL D B 1 FT #HET 98 98 GLY D 32 405 CL D B 1 FT #HET 100 100 ALA D 32 405 CL D B 2 FT #HET 101 101 GLY D 3 403 CL A B 2 FT #HET 101 101 GLY D 32 405 CL D B 1 FT #HET 102 102 ILE D 3 403 CL A A 2 FT #HET 102 102 ILE D 32 405 CL D B 2 FT #HET 103 103 THR D 32 405 CL D A 4 FT #HET 134 134 ARG D 36 409 GOL D S 5 FT #HET 135 135 THR D 36 409 GOL D S 2 FT #HET 137 137 GLY D 36 409 GOL D B 4 FT #HET 138 138 VAL D 36 409 GOL D B 2 FT #HET 139 139 GLU D 36 409 GOL D A 7 FT #HET 147 147 TRP D 38 411 0YR D S 1 FT #HET 172 172 LYS D 34 407 MG D S 1 FT #HET 172 172 LYS D 38 411 0YR D S 3 FT #HET 174 174 LYS D 38 411 0YR D S 7 FT #HET 180 180 PRO D 35 408 GOL D S 5 FT #HET 181 181 ASN D 35 408 GOL D S 6 FT #HET 184 184 ILE D 35 408 GOL D S 1 FT #HET 203 203 ASP D 34 407 MG D S 3 FT #HET 203 203 ASP D 38 411 0YR D S 5 FT #HET 205 205 ASN D 34 407 MG D S 1 FT #HET 205 205 ASN D 38 411 0YR D S 7 FT #HET 215 215 ARG D 35 408 GOL D A 13 FT #HET 216 216 PHE D 35 408 GOL D B 2 FT #HET 219 219 ALA D 35 408 GOL D S 2 FT #HET 224 224 ASP D 84 406 GOL K S 5 FT #HET 226 226 TYR D 29 402 CL D S 3 FT #HET 229 229 GLU D 34 407 MG D S 4 FT #HET 229 229 GLU D 38 411 0YR D S 2 FT #HET 233 233 TRP D 9 409 GOL A S 4 FT #HET 255 255 GLU D 34 407 MG D S 3 FT #HET 255 255 GLU D 38 411 0YR D S 10 FT #HET 268 268 ASP D 28 401 CA D S 3 FT #HET 274 274 TYR D 29 402 CL D S 1 FT #HET 298 298 HIS D 28 401 CA D S 2 FT #HET 302 302 VAL D 31 404 CL D B 2 FT #HET 304 304 PRO D 31 404 CL D S 1 FT #HET 305 305 HIS D 38 411 0YR D S 9 FT #HET 309 309 MET D 30 403 CL D S 1 FT #HET 317 317 SER D 31 404 CL D S 2 FT #HET 323 323 SER D 31 404 CL D A 3 FT #HET 323 323 SER D 36 409 GOL D B 1 FT #HET 324 324 THR D 29 402 CL D S 3 FT #HET 324 324 THR D 31 404 CL D B 4 FT #HET 324 324 THR D 36 409 GOL D A 7 FT #HET 325 325 ILE D 29 402 CL D S 1 FT #HET 325 325 ILE D 31 404 CL D B 3 FT #HET 325 325 ILE D 36 409 GOL D A 2 FT #HET 327 327 GLU D 38 411 0YR D S 4 FT #HET 329 329 ILE D 30 403 CL D B 2 FT #HET 330 330 PRO D 30 403 CL D B 3 FT #HET 331 331 TRP D 30 403 CL D B 3 FT #HET 332 332 ILE D 30 403 CL D A 4 FT #HET 333 333 LYS D 30 403 CL D A 3 FT #HET 370 370 ALA D 33 406 CL D A 3 FT #HET 371 371 VAL D 33 406 CL D A 2 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19E STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 224 224 ASP E 181 181 ASN B Protein S 1 FT #SUB 225 225 ILE E 215 215 ARG B Protein B 1 FT #SUB 226 226 TYR E 215 215 ARG B Protein A 16 FT #SUB 244 244 ALA E 246 246 ASN B Protein B 1 FT #SUB 245 245 ARG E 242 242 ARG B Protein S 2 FT #SUB 247 247 THR E 214 214 GLN B Protein B 1 FT #SUB 247 247 THR E 246 246 ASN B Protein B 3 FT #SUB 248 248 SER E 214 214 GLN B Protein A 5 FT #SUB 248 248 SER E 218 218 ALA B Protein S 1 FT #SUB 248 248 SER E 246 246 ASN B Protein A 2 FT #SUB 250 250 PRO E 211 211 PRO B Protein S 3 FT #SUB 250 250 PRO E 215 215 ARG B Protein S 2 FT #SUB 268 268 ASP E 242 242 ARG B Protein B 1 FT #SUB 270 270 GLY E 242 242 ARG B Protein B 6 FT #SUB 273 273 ALA E 211 211 PRO B Protein S 2 FT #SUB 274 274 TYR E 211 211 PRO B Protein S 7 FT #SUB 274 274 TYR E 212 212 THR B Protein S 1 FT #SUB 274 274 TYR E 215 215 ARG B Protein S 4 FT #SUB 298 298 HIS E 236 236 ASP B Protein B 1 FT #SUB 298 298 HIS E 239 239 SER B Protein B 1 FT #SUB 299 299 ARG E 233 233 TRP B Protein S 3 FT #SUB 299 299 ARG E 236 236 ASP B Protein S 2 FT #SUB 301 301 PRO E 209 209 ASP B Protein S 3 FT #SUB 362 362 GLU E 136 136 ALA D Protein A 6 FT #SUB 364 364 PHE E 343 343 ARG D Protein B 2 FT #SUB 365 365 THR E 347 347 TYR D Protein S 1 FT #SUB 365 365 THR E 348 348 LYS D Protein A 2 FT #SUB 366 366 ARG E 348 348 LYS D Protein B 2 FT #SUB 366 366 ARG E 349 349 ARG D Protein S 1 FT #SUB 366 366 ARG E 351 351 GLU D Protein S 4 FT #SUB 368 368 GLY E 343 343 ARG D Protein B 3 FT #SUB 369 369 LYS E 343 343 ARG D Protein B 1 FT #SUB 77 77 ASP E 128 128 HIS G Protein S 1 FT #SUB 79 79 SER E 128 128 HIS G Protein S 1 FT #SUB 80 80 ASP E 128 128 HIS G Protein S 2 FT #SUB 80 80 ASP E 131 131 GLY G Protein A 5 FT #SUB 80 80 ASP E 132 132 GLY G Protein S 1 FT #SUB 81 81 HIS E 130 130 LEU G Protein S 2 FT #SUB 81 81 HIS E 131 131 GLY G Protein A 3 FT #SUB 82 82 SER E 130 130 LEU G Protein S 1 FT #SUB 82 82 SER E 131 131 GLY G Protein A 9 FT #SUB 82 82 SER E 319 319 TRP G Protein S 3 FT #SUB 83 83 ARG E 131 131 GLY G Protein B 1 FT #SUB 83 83 ARG E 133 133 ALA G Protein S 3 FT #SUB 90 90 ARG E 299 299 ARG G Protein S 1 FT #SUB 128 128 HIS E 77 77 ASP G Protein S 1 FT #SUB 128 128 HIS E 79 79 SER G Protein S 2 FT #SUB 128 128 HIS E 80 80 ASP G Protein S 2 FT #SUB 129 129 TYR E 129 129 TYR G Protein S 7 FT #SUB 130 130 LEU E 81 81 HIS G Protein B 2 FT #SUB 130 130 LEU E 82 82 SER G Protein B 1 FT #SUB 131 131 GLY E 79 79 SER G Protein B 1 FT #SUB 131 131 GLY E 80 80 ASP G Protein B 6 FT #SUB 131 131 GLY E 81 81 HIS G Protein B 4 FT #SUB 131 131 GLY E 82 82 SER G Protein B 10 FT #SUB 131 131 GLY E 83 83 ARG G Protein B 1 FT #SUB 132 132 GLY E 80 80 ASP G Protein B 1 FT #SUB 133 133 ALA E 83 83 ARG G Protein B 3 FT #SUB 260 260 VAL E 297 297 ALA G Protein S 2 FT #SUB 260 260 VAL E 299 299 ARG G Protein S 1 FT #SUB 261 261 ASP E 299 299 ARG G Protein S 10 FT #SUB 264 264 ARG E 297 297 ALA G Protein S 4 FT #SUB 264 264 ARG E 298 298 HIS G Protein S 12 FT #SUB 268 268 ASP E 268 268 ASP G Protein S 1 FT #SUB 268 268 ASP E 298 298 HIS G Protein S 2 FT #SUB 290 290 GLN E 293 293 ASP G Protein A 3 FT #SUB 290 290 GLN E 296 296 LEU G Protein S 2 FT #SUB 293 293 ASP E 289 289 ILE G Protein S 1 FT #SUB 293 293 ASP E 290 290 GLN G Protein S 4 FT #SUB 293 293 ASP E 293 293 ASP G Protein S 6 FT #SUB 294 294 LEU E 294 294 LEU G Protein S 1 FT #SUB 294 294 LEU E 297 297 ALA G Protein S 1 FT #SUB 296 296 LEU E 260 260 VAL G Protein S 1 FT #SUB 296 296 LEU E 290 290 GLN G Protein S 3 FT #SUB 297 297 ALA E 260 260 VAL G Protein A 2 FT #SUB 297 297 ALA E 264 264 ARG G Protein B 4 FT #SUB 298 298 HIS E 264 264 ARG G Protein A 12 FT #SUB 298 298 HIS E 268 268 ASP G Protein S 5 FT #SUB 299 299 ARG E 90 90 ARG G Protein S 1 FT #SUB 299 299 ARG E 260 260 VAL G Protein S 1 FT #SUB 299 299 ARG E 261 261 ASP G Protein S 10 FT #SUB 319 319 TRP E 82 82 SER G Protein S 4 FT #SUB 24 24 THR E 92 92 PRO H Protein B 2 FT #SUB 25 25 HIS E 92 92 PRO H Protein S 6 FT #SUB 25 25 HIS E 96 96 TRP H Protein S 1 FT #SUB 50 50 GLY E 96 96 TRP H Protein B 4 FT #SUB 51 51 THR E 96 96 TRP H Protein B 2 FT #SUB 52 52 HIS E 96 96 TRP H Protein S 9 FT #SUB 54 54 HIS E 68 68 CYS H Protein S 1 FT #SUB 54 54 HIS E 93 93 SER H Protein S 4 FT #SUB 54 54 HIS E 94 94 LEU H Protein S 2 FT #SUB 56 56 PRO E 67 67 ASP H Protein S 3 FT #SUB 56 56 PRO E 68 68 CYS H Protein A 2 FT #SUB 57 57 SER E 68 68 CYS H Protein B 1 FT #SUB 57 57 SER E 94 94 LEU H Protein S 2 FT #SUB 60 60 LEU E 60 60 LEU H Protein A 2 FT #SUB 60 60 LEU E 63 63 SER H Protein S 1 FT #SUB 60 60 LEU E 64 64 CYS H Protein S 2 FT #SUB 63 63 SER E 60 60 LEU H Protein S 1 FT #SUB 64 64 CYS E 60 60 LEU H Protein A 2 FT #SUB 67 67 ASP E 56 56 PRO H Protein A 4 FT #SUB 68 68 CYS E 54 54 HIS H Protein S 1 FT #SUB 68 68 CYS E 56 56 PRO H Protein S 2 FT #SUB 68 68 CYS E 57 57 SER H Protein S 2 FT #SUB 90 90 ARG E 233 233 TRP H Protein S 4 FT #SUB 92 92 PRO E 24 24 THR H Protein S 2 FT #SUB 92 92 PRO E 25 25 HIS H Protein A 5 FT #SUB 93 93 SER E 52 52 HIS H Protein S 1 FT #SUB 93 93 SER E 54 54 HIS H Protein S 4 FT #SUB 94 94 LEU E 54 54 HIS H Protein S 2 FT #SUB 94 94 LEU E 57 57 SER H Protein S 2 FT #SUB 95 95 GLN E 233 233 TRP H Protein S 1 FT #SUB 95 95 GLN E 234 234 TYR H Protein S 2 FT #SUB 96 96 TRP E 25 25 HIS H Protein S 1 FT #SUB 96 96 TRP E 30 30 TRP H Protein S 1 FT #SUB 96 96 TRP E 50 50 GLY H Protein S 4 FT #SUB 96 96 TRP E 51 51 THR H Protein S 2 FT #SUB 96 96 TRP E 52 52 HIS H Protein S 12 FT #SUB 96 96 TRP E 255 255 GLU H Protein S 2 FT #SUB 96 96 TRP E 256 256 GLN H Protein S 3 FT #SUB 96 96 TRP E 281 281 ARG H Protein A 7 FT #SUB 97 97 VAL E 101 101 GLY H Protein B 1 FT #SUB 97 97 VAL E 102 102 ILE H Protein A 4 FT #SUB 97 97 VAL E 105 105 LEU H Protein A 3 FT #SUB 97 97 VAL E 258 258 TYR H Protein B 2 FT #SUB 98 98 GLY E 258 258 TYR H Protein B 6 FT #SUB 99 99 ARG E 234 234 TYR H Protein S 1 FT #SUB 99 99 ARG E 235 235 ASP H Protein S 9 FT #SUB 99 99 ARG E 256 256 GLN H Protein S 7 FT #SUB 99 99 ARG E 258 258 TYR H Protein S 1 FT #SUB 100 100 ALA E 100 100 ALA H Protein S 1 FT #SUB 100 100 ALA E 101 101 GLY H Protein B 1 FT #SUB 101 101 GLY E 97 97 VAL H Protein B 1 FT #SUB 101 101 GLY E 100 100 ALA H Protein B 1 FT #SUB 102 102 ILE E 97 97 VAL H Protein A 4 FT #SUB 102 102 ILE E 102 102 ILE H Protein S 2 FT #SUB 105 105 LEU E 97 97 VAL H Protein S 3 FT #SUB 233 233 TRP E 90 90 ARG H Protein S 3 FT #SUB 233 233 TRP E 95 95 GLN H Protein S 2 FT #SUB 233 233 TRP E 261 261 ASP H Protein S 6 FT #SUB 234 234 TYR E 95 95 GLN H Protein S 2 FT #SUB 234 234 TYR E 99 99 ARG H Protein S 1 FT #SUB 235 235 ASP E 99 99 ARG H Protein S 9 FT #SUB 235 235 ASP E 261 261 ASP H Protein A 3 FT #SUB 236 236 ASP E 264 264 ARG H Protein S 3 FT #SUB 238 238 THR E 264 264 ARG H Protein S 3 FT #SUB 255 255 GLU E 96 96 TRP H Protein S 2 FT #SUB 256 256 GLN E 96 96 TRP H Protein S 3 FT #SUB 256 256 GLN E 99 99 ARG H Protein A 7 FT #SUB 258 258 TYR E 97 97 VAL H Protein S 3 FT #SUB 258 258 TYR E 98 98 GLY H Protein S 6 FT #SUB 258 258 TYR E 99 99 ARG H Protein S 1 FT #SUB 261 261 ASP E 233 233 TRP H Protein S 6 FT #SUB 261 261 ASP E 235 235 ASP H Protein S 3 FT #SUB 264 264 ARG E 236 236 ASP H Protein S 3 FT #SUB 264 264 ARG E 238 238 THR H Protein S 3 FT #SUB 281 281 ARG E 96 96 TRP H Protein S 8 FT #SUB 181 181 ASN E 224 224 ASP I Protein S 1 FT #SUB 209 209 ASP E 299 299 ARG I Protein S 1 FT #SUB 209 209 ASP E 301 301 PRO I Protein S 3 FT #SUB 211 211 PRO E 250 250 PRO I Protein A 4 FT #SUB 211 211 PRO E 273 273 ALA I Protein S 1 FT #SUB 211 211 PRO E 274 274 TYR I Protein S 6 FT #SUB 214 214 GLN E 247 247 THR I Protein S 1 FT #SUB 214 214 GLN E 248 248 SER I Protein S 4 FT #SUB 215 215 ARG E 225 225 ILE I Protein S 1 FT #SUB 215 215 ARG E 226 226 TYR I Protein S 16 FT #SUB 215 215 ARG E 250 250 PRO I Protein S 2 FT #SUB 215 215 ARG E 274 274 TYR I Protein S 3 FT #SUB 218 218 ALA E 248 248 SER I Protein S 2 FT #SUB 221 221 LYS E 222 222 ASP I Protein S 1 FT #SUB 233 233 TRP E 299 299 ARG I Protein S 3 FT #SUB 236 236 ASP E 298 298 HIS I Protein S 1 FT #SUB 236 236 ASP E 299 299 ARG I Protein S 2 FT #SUB 239 239 SER E 298 298 HIS I Protein S 1 FT #SUB 242 242 ARG E 245 245 ARG I Protein S 1 FT #SUB 242 242 ARG E 267 267 ILE I Protein S 1 FT #SUB 242 242 ARG E 268 268 ASP I Protein S 1 FT #SUB 242 242 ARG E 270 270 GLY I Protein S 6 FT #SUB 246 246 ASN E 244 244 ALA I Protein S 1 FT #SUB 246 246 ASN E 247 247 THR I Protein S 2 FT #SUB 246 246 ASN E 248 248 SER I Protein S 3 FT #SUB 41 41 ASP E 151 151 THR K Protein B 1 FT #HET 22 22 ASP E 46 408 0YR E S 8 FT #HET 25 25 HIS E 46 408 0YR E S 3 FT #HET 30 30 TRP E 46 408 0YR E S 2 FT #HET 52 52 HIS E 46 408 0YR E S 7 FT #HET 90 90 ARG E 45 407 GOL E S 7 FT #HET 96 96 TRP E 72 409 0YR H S 3 FT #HET 97 97 VAL E 40 402 CL E B 1 FT #HET 98 98 GLY E 40 402 CL E B 1 FT #HET 100 100 ALA E 40 402 CL E B 2 FT #HET 101 101 GLY E 40 402 CL E B 1 FT #HET 101 101 GLY E 66 403 CL H B 2 FT #HET 102 102 ILE E 40 402 CL E B 1 FT #HET 102 102 ILE E 66 403 CL H A 2 FT #HET 103 103 THR E 40 402 CL E A 4 FT #HET 134 134 ARG E 44 406 GOL E S 4 FT #HET 137 137 GLY E 44 406 GOL E B 1 FT #HET 138 138 VAL E 44 406 GOL E B 2 FT #HET 139 139 GLU E 44 406 GOL E A 9 FT #HET 147 147 TRP E 46 408 0YR E S 1 FT #HET 172 172 LYS E 42 404 MG E S 1 FT #HET 172 172 LYS E 46 408 0YR E S 3 FT #HET 174 174 LYS E 46 408 0YR E S 7 FT #HET 180 180 PRO E 43 405 GOL E S 5 FT #HET 181 181 ASN E 43 405 GOL E S 6 FT #HET 184 184 ILE E 43 405 GOL E S 1 FT #HET 203 203 ASP E 42 404 MG E S 3 FT #HET 203 203 ASP E 46 408 0YR E S 4 FT #HET 205 205 ASN E 42 404 MG E S 1 FT #HET 205 205 ASN E 46 408 0YR E S 7 FT #HET 215 215 ARG E 43 405 GOL E A 13 FT #HET 216 216 PHE E 43 405 GOL E B 1 FT #HET 219 219 ALA E 43 405 GOL E S 2 FT #HET 224 224 ASP E 16 406 GOL B S 5 FT #HET 226 226 TYR E 39 401 CL E S 3 FT #HET 229 229 GLU E 42 404 MG E S 3 FT #HET 229 229 GLU E 46 408 0YR E S 2 FT #HET 233 233 TRP E 71 408 GOL H S 2 FT #HET 255 255 GLU E 42 404 MG E S 3 FT #HET 255 255 GLU E 46 408 0YR E S 11 FT #HET 268 268 ASP E 55 401 CA G S 3 FT #HET 274 274 TYR E 39 401 CL E S 1 FT #HET 298 298 HIS E 55 401 CA G S 3 FT #HET 299 299 ARG E 62 408 GOL G S 5 FT #HET 305 305 HIS E 46 408 0YR E S 9 FT #HET 309 309 MET E 41 403 CL E S 1 FT #HET 324 324 THR E 39 401 CL E S 2 FT #HET 324 324 THR E 44 406 GOL E B 7 FT #HET 325 325 ILE E 39 401 CL E S 1 FT #HET 325 325 ILE E 44 406 GOL E S 2 FT #HET 327 327 GLU E 46 408 0YR E S 5 FT #HET 329 329 ILE E 41 403 CL E B 2 FT #HET 330 330 PRO E 41 403 CL E B 3 FT #HET 331 331 TRP E 41 403 CL E B 3 FT #HET 332 332 ILE E 41 403 CL E A 4 FT #HET 333 333 LYS E 41 403 CL E A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19F STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 222 222 ASP F 221 221 LYS A Protein S 1 FT #SUB 224 224 ASP F 181 181 ASN A Protein S 1 FT #SUB 225 225 ILE F 215 215 ARG A Protein B 1 FT #SUB 226 226 TYR F 215 215 ARG A Protein A 14 FT #SUB 244 244 ALA F 246 246 ASN A Protein B 1 FT #SUB 245 245 ARG F 242 242 ARG A Protein S 1 FT #SUB 247 247 THR F 214 214 GLN A Protein B 1 FT #SUB 247 247 THR F 246 246 ASN A Protein B 2 FT #SUB 248 248 SER F 214 214 GLN A Protein A 5 FT #SUB 248 248 SER F 218 218 ALA A Protein S 2 FT #SUB 248 248 SER F 246 246 ASN A Protein A 3 FT #SUB 250 250 PRO F 211 211 PRO A Protein S 3 FT #SUB 250 250 PRO F 215 215 ARG A Protein S 3 FT #SUB 268 268 ASP F 242 242 ARG A Protein B 1 FT #SUB 270 270 GLY F 242 242 ARG A Protein B 5 FT #SUB 273 273 ALA F 211 211 PRO A Protein S 2 FT #SUB 274 274 TYR F 211 211 PRO A Protein S 6 FT #SUB 274 274 TYR F 215 215 ARG A Protein S 4 FT #SUB 298 298 HIS F 236 236 ASP A Protein B 1 FT #SUB 298 298 HIS F 239 239 SER A Protein B 1 FT #SUB 299 299 ARG F 233 233 TRP A Protein S 4 FT #SUB 299 299 ARG F 236 236 ASP A Protein S 2 FT #SUB 301 301 PRO F 209 209 ASP A Protein S 3 FT #SUB 77 77 ASP F 128 128 HIS D Protein S 1 FT #SUB 79 79 SER F 128 128 HIS D Protein S 1 FT #SUB 79 79 SER F 131 131 GLY D Protein B 1 FT #SUB 80 80 ASP F 128 128 HIS D Protein S 2 FT #SUB 80 80 ASP F 131 131 GLY D Protein A 6 FT #SUB 80 80 ASP F 132 132 GLY D Protein S 1 FT #SUB 81 81 HIS F 130 130 LEU D Protein S 2 FT #SUB 81 81 HIS F 131 131 GLY D Protein A 4 FT #SUB 82 82 SER F 130 130 LEU D Protein S 1 FT #SUB 82 82 SER F 131 131 GLY D Protein A 10 FT #SUB 82 82 SER F 319 319 TRP D Protein S 4 FT #SUB 83 83 ARG F 131 131 GLY D Protein B 1 FT #SUB 83 83 ARG F 133 133 ALA D Protein S 3 FT #SUB 90 90 ARG F 299 299 ARG D Protein S 1 FT #SUB 118 118 LYS F 128 128 HIS D Protein S 1 FT #SUB 118 118 LYS F 129 129 TYR D Protein S 3 FT #SUB 128 128 HIS F 77 77 ASP D Protein S 1 FT #SUB 128 128 HIS F 79 79 SER D Protein S 2 FT #SUB 128 128 HIS F 80 80 ASP D Protein S 2 FT #SUB 129 129 TYR F 118 118 LYS D Protein B 1 FT #SUB 129 129 TYR F 129 129 TYR D Protein S 6 FT #SUB 130 130 LEU F 81 81 HIS D Protein B 2 FT #SUB 130 130 LEU F 82 82 SER D Protein B 1 FT #SUB 131 131 GLY F 79 79 SER D Protein B 1 FT #SUB 131 131 GLY F 80 80 ASP D Protein B 6 FT #SUB 131 131 GLY F 81 81 HIS D Protein B 4 FT #SUB 131 131 GLY F 82 82 SER D Protein B 10 FT #SUB 131 131 GLY F 83 83 ARG D Protein B 1 FT #SUB 132 132 GLY F 80 80 ASP D Protein B 1 FT #SUB 133 133 ALA F 83 83 ARG D Protein B 3 FT #SUB 260 260 VAL F 296 296 LEU D Protein S 1 FT #SUB 260 260 VAL F 297 297 ALA D Protein S 2 FT #SUB 260 260 VAL F 299 299 ARG D Protein S 1 FT #SUB 261 261 ASP F 299 299 ARG D Protein S 10 FT #SUB 264 264 ARG F 297 297 ALA D Protein S 4 FT #SUB 264 264 ARG F 298 298 HIS D Protein S 12 FT #SUB 268 268 ASP F 268 268 ASP D Protein S 1 FT #SUB 268 268 ASP F 298 298 HIS D Protein S 5 FT #SUB 289 289 ILE F 293 293 ASP D Protein B 1 FT #SUB 290 290 GLN F 293 293 ASP D Protein A 4 FT #SUB 290 290 GLN F 296 296 LEU D Protein S 2 FT #SUB 293 293 ASP F 289 289 ILE D Protein S 1 FT #SUB 293 293 ASP F 290 290 GLN D Protein S 4 FT #SUB 293 293 ASP F 293 293 ASP D Protein S 6 FT #SUB 294 294 LEU F 294 294 LEU D Protein S 1 FT #SUB 294 294 LEU F 297 297 ALA D Protein S 1 FT #SUB 296 296 LEU F 260 260 VAL D Protein S 1 FT #SUB 296 296 LEU F 290 290 GLN D Protein S 3 FT #SUB 297 297 ALA F 260 260 VAL D Protein S 1 FT #SUB 297 297 ALA F 264 264 ARG D Protein B 4 FT #SUB 297 297 ALA F 294 294 LEU D Protein S 1 FT #SUB 298 298 HIS F 264 264 ARG D Protein A 12 FT #SUB 298 298 HIS F 268 268 ASP D Protein S 2 FT #SUB 299 299 ARG F 90 90 ARG D Protein S 1 FT #SUB 299 299 ARG F 260 260 VAL D Protein S 1 FT #SUB 299 299 ARG F 261 261 ASP D Protein S 11 FT #SUB 319 319 TRP F 82 82 SER D Protein S 4 FT #SUB 24 24 THR F 92 92 PRO K Protein B 2 FT #SUB 25 25 HIS F 92 92 PRO K Protein S 6 FT #SUB 25 25 HIS F 96 96 TRP K Protein S 1 FT #SUB 50 50 GLY F 96 96 TRP K Protein B 4 FT #SUB 51 51 THR F 96 96 TRP K Protein B 2 FT #SUB 52 52 HIS F 96 96 TRP K Protein A 7 FT #SUB 54 54 HIS F 68 68 CYS K Protein S 1 FT #SUB 54 54 HIS F 93 93 SER K Protein S 4 FT #SUB 54 54 HIS F 94 94 LEU K Protein S 2 FT #SUB 56 56 PRO F 67 67 ASP K Protein S 3 FT #SUB 56 56 PRO F 68 68 CYS K Protein A 3 FT #SUB 57 57 SER F 68 68 CYS K Protein A 3 FT #SUB 57 57 SER F 94 94 LEU K Protein S 2 FT #SUB 60 60 LEU F 60 60 LEU K Protein A 2 FT #SUB 60 60 LEU F 63 63 SER K Protein S 1 FT #SUB 60 60 LEU F 64 64 CYS K Protein S 2 FT #SUB 63 63 SER F 60 60 LEU K Protein S 1 FT #SUB 64 64 CYS F 60 60 LEU K Protein A 2 FT #SUB 67 67 ASP F 56 56 PRO K Protein A 4 FT #SUB 68 68 CYS F 54 54 HIS K Protein S 1 FT #SUB 68 68 CYS F 56 56 PRO K Protein S 2 FT #SUB 68 68 CYS F 57 57 SER K Protein S 2 FT #SUB 68 68 CYS F 60 60 LEU K Protein S 1 FT #SUB 90 90 ARG F 233 233 TRP K Protein S 3 FT #SUB 92 92 PRO F 24 24 THR K Protein S 2 FT #SUB 92 92 PRO F 25 25 HIS K Protein A 5 FT #SUB 93 93 SER F 54 54 HIS K Protein S 4 FT #SUB 94 94 LEU F 54 54 HIS K Protein S 1 FT #SUB 94 94 LEU F 57 57 SER K Protein S 1 FT #SUB 95 95 GLN F 233 233 TRP K Protein S 1 FT #SUB 95 95 GLN F 234 234 TYR K Protein S 2 FT #SUB 96 96 TRP F 25 25 HIS K Protein S 2 FT #SUB 96 96 TRP F 30 30 TRP K Protein S 1 FT #SUB 96 96 TRP F 50 50 GLY K Protein S 4 FT #SUB 96 96 TRP F 51 51 THR K Protein S 2 FT #SUB 96 96 TRP F 52 52 HIS K Protein S 11 FT #SUB 96 96 TRP F 255 255 GLU K Protein S 1 FT #SUB 96 96 TRP F 256 256 GLN K Protein S 3 FT #SUB 96 96 TRP F 281 281 ARG K Protein A 8 FT #SUB 97 97 VAL F 57 57 SER K Protein S 1 FT #SUB 97 97 VAL F 101 101 GLY K Protein B 1 FT #SUB 97 97 VAL F 102 102 ILE K Protein A 4 FT #SUB 97 97 VAL F 105 105 LEU K Protein A 3 FT #SUB 97 97 VAL F 258 258 TYR K Protein B 2 FT #SUB 98 98 GLY F 258 258 TYR K Protein B 6 FT #SUB 99 99 ARG F 234 234 TYR K Protein S 2 FT #SUB 99 99 ARG F 235 235 ASP K Protein S 9 FT #SUB 99 99 ARG F 256 256 GLN K Protein S 7 FT #SUB 99 99 ARG F 258 258 TYR K Protein S 1 FT #SUB 100 100 ALA F 100 100 ALA K Protein S 1 FT #SUB 100 100 ALA F 101 101 GLY K Protein B 1 FT #SUB 101 101 GLY F 97 97 VAL K Protein B 1 FT #SUB 101 101 GLY F 100 100 ALA K Protein B 1 FT #SUB 102 102 ILE F 97 97 VAL K Protein A 4 FT #SUB 102 102 ILE F 102 102 ILE K Protein S 3 FT #SUB 105 105 LEU F 97 97 VAL K Protein S 3 FT #SUB 233 233 TRP F 90 90 ARG K Protein S 5 FT #SUB 233 233 TRP F 95 95 GLN K Protein S 2 FT #SUB 233 233 TRP F 261 261 ASP K Protein S 6 FT #SUB 234 234 TYR F 95 95 GLN K Protein S 2 FT #SUB 234 234 TYR F 99 99 ARG K Protein S 1 FT #SUB 235 235 ASP F 99 99 ARG K Protein S 9 FT #SUB 235 235 ASP F 261 261 ASP K Protein A 3 FT #SUB 236 236 ASP F 264 264 ARG K Protein S 3 FT #SUB 238 238 THR F 264 264 ARG K Protein S 4 FT #SUB 255 255 GLU F 96 96 TRP K Protein S 2 FT #SUB 256 256 GLN F 96 96 TRP K Protein S 3 FT #SUB 256 256 GLN F 99 99 ARG K Protein A 8 FT #SUB 258 258 TYR F 97 97 VAL K Protein S 3 FT #SUB 258 258 TYR F 98 98 GLY K Protein S 6 FT #SUB 258 258 TYR F 99 99 ARG K Protein S 1 FT #SUB 261 261 ASP F 233 233 TRP K Protein S 6 FT #SUB 261 261 ASP F 235 235 ASP K Protein S 3 FT #SUB 264 264 ARG F 236 236 ASP K Protein S 3 FT #SUB 264 264 ARG F 238 238 THR K Protein S 4 FT #SUB 281 281 ARG F 96 96 TRP K Protein S 8 FT #HET 22 22 ASP F 54 408 0YR F S 9 FT #HET 25 25 HIS F 54 408 0YR F S 3 FT #HET 30 30 TRP F 54 408 0YR F S 2 FT #HET 52 52 HIS F 54 408 0YR F S 8 FT #HET 96 96 TRP F 87 409 0YR K S 4 FT #HET 97 97 VAL F 48 402 CL F B 1 FT #HET 98 98 GLY F 48 402 CL F B 1 FT #HET 100 100 ALA F 48 402 CL F B 2 FT #HET 101 101 GLY F 48 402 CL F B 1 FT #HET 101 101 GLY F 81 403 CL K B 2 FT #HET 102 102 ILE F 48 402 CL F B 3 FT #HET 102 102 ILE F 81 403 CL K A 3 FT #HET 103 103 THR F 48 402 CL F A 5 FT #HET 134 134 ARG F 52 406 GOL F S 5 FT #HET 137 137 GLY F 52 406 GOL F B 2 FT #HET 138 138 VAL F 52 406 GOL F B 3 FT #HET 139 139 GLU F 52 406 GOL F A 6 FT #HET 147 147 TRP F 54 408 0YR F S 1 FT #HET 172 172 LYS F 50 404 MG F S 1 FT #HET 172 172 LYS F 54 408 0YR F S 3 FT #HET 174 174 LYS F 54 408 0YR F S 6 FT #HET 180 180 PRO F 51 405 GOL F S 5 FT #HET 181 181 ASN F 51 405 GOL F S 7 FT #HET 184 184 ILE F 51 405 GOL F S 1 FT #HET 203 203 ASP F 50 404 MG F S 3 FT #HET 203 203 ASP F 54 408 0YR F S 5 FT #HET 205 205 ASN F 54 408 0YR F S 7 FT #HET 207 207 LYS F 53 407 GOL F B 1 FT #HET 208 208 TRP F 53 407 GOL F A 5 FT #HET 209 209 ASP F 53 407 GOL F A 10 FT #HET 212 212 THR F 53 407 GOL F S 4 FT #HET 215 215 ARG F 51 405 GOL F A 13 FT #HET 216 216 PHE F 51 405 GOL F B 1 FT #HET 219 219 ALA F 51 405 GOL F S 2 FT #HET 224 224 ASP F 6 406 GOL A S 5 FT #HET 226 226 TYR F 47 401 CL F S 3 FT #HET 229 229 GLU F 50 404 MG F S 4 FT #HET 229 229 GLU F 54 408 0YR F S 2 FT #HET 255 255 GLU F 50 404 MG F S 3 FT #HET 255 255 GLU F 54 408 0YR F S 10 FT #HET 268 268 ASP F 28 401 CA D S 3 FT #HET 274 274 TYR F 47 401 CL F S 1 FT #HET 298 298 HIS F 28 401 CA D S 3 FT #HET 299 299 ARG F 37 410 GOL D S 4 FT #HET 305 305 HIS F 54 408 0YR F S 9 FT #HET 309 309 MET F 49 403 CL F S 1 FT #HET 324 324 THR F 47 401 CL F S 2 FT #HET 324 324 THR F 52 406 GOL F A 8 FT #HET 325 325 ILE F 52 406 GOL F S 1 FT #HET 327 327 GLU F 54 408 0YR F S 4 FT #HET 329 329 ILE F 49 403 CL F B 2 FT #HET 330 330 PRO F 49 403 CL F B 4 FT #HET 331 331 TRP F 49 403 CL F B 3 FT #HET 332 332 ILE F 49 403 CL F A 4 FT #HET 333 333 LYS F 49 403 CL F A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19G STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 24 24 THR G 92 92 PRO B Protein B 2 FT #SUB 25 25 HIS G 92 92 PRO B Protein S 5 FT #SUB 25 25 HIS G 96 96 TRP B Protein S 1 FT #SUB 50 50 GLY G 96 96 TRP B Protein B 4 FT #SUB 51 51 THR G 96 96 TRP B Protein B 2 FT #SUB 52 52 HIS G 96 96 TRP B Protein S 8 FT #SUB 54 54 HIS G 68 68 CYS B Protein S 1 FT #SUB 54 54 HIS G 93 93 SER B Protein S 4 FT #SUB 54 54 HIS G 94 94 LEU B Protein S 2 FT #SUB 56 56 PRO G 67 67 ASP B Protein S 4 FT #SUB 56 56 PRO G 68 68 CYS B Protein A 2 FT #SUB 57 57 SER G 68 68 CYS B Protein B 1 FT #SUB 57 57 SER G 94 94 LEU B Protein S 2 FT #SUB 57 57 SER G 97 97 VAL B Protein S 1 FT #SUB 60 60 LEU G 60 60 LEU B Protein A 2 FT #SUB 60 60 LEU G 63 63 SER B Protein S 1 FT #SUB 60 60 LEU G 64 64 CYS B Protein S 2 FT #SUB 63 63 SER G 60 60 LEU B Protein A 2 FT #SUB 64 64 CYS G 60 60 LEU B Protein A 2 FT #SUB 67 67 ASP G 56 56 PRO B Protein A 4 FT #SUB 68 68 CYS G 56 56 PRO B Protein S 2 FT #SUB 68 68 CYS G 57 57 SER B Protein S 3 FT #SUB 90 90 ARG G 233 233 TRP B Protein S 2 FT #SUB 92 92 PRO G 24 24 THR B Protein S 2 FT #SUB 92 92 PRO G 25 25 HIS B Protein A 5 FT #SUB 93 93 SER G 54 54 HIS B Protein S 4 FT #SUB 94 94 LEU G 54 54 HIS B Protein S 2 FT #SUB 94 94 LEU G 57 57 SER B Protein S 2 FT #SUB 95 95 GLN G 233 233 TRP B Protein S 2 FT #SUB 95 95 GLN G 234 234 TYR B Protein S 2 FT #SUB 96 96 TRP G 25 25 HIS B Protein S 2 FT #SUB 96 96 TRP G 30 30 TRP B Protein S 1 FT #SUB 96 96 TRP G 50 50 GLY B Protein S 4 FT #SUB 96 96 TRP G 51 51 THR B Protein S 2 FT #SUB 96 96 TRP G 52 52 HIS B Protein S 9 FT #SUB 96 96 TRP G 255 255 GLU B Protein S 2 FT #SUB 96 96 TRP G 256 256 GLN B Protein S 3 FT #SUB 96 96 TRP G 281 281 ARG B Protein A 8 FT #SUB 97 97 VAL G 101 101 GLY B Protein B 1 FT #SUB 97 97 VAL G 102 102 ILE B Protein A 5 FT #SUB 97 97 VAL G 105 105 LEU B Protein A 3 FT #SUB 97 97 VAL G 258 258 TYR B Protein B 2 FT #SUB 98 98 GLY G 258 258 TYR B Protein B 6 FT #SUB 99 99 ARG G 234 234 TYR B Protein S 1 FT #SUB 99 99 ARG G 235 235 ASP B Protein S 10 FT #SUB 99 99 ARG G 256 256 GLN B Protein S 7 FT #SUB 99 99 ARG G 258 258 TYR B Protein S 1 FT #SUB 100 100 ALA G 100 100 ALA B Protein S 1 FT #SUB 100 100 ALA G 101 101 GLY B Protein B 1 FT #SUB 101 101 GLY G 97 97 VAL B Protein B 1 FT #SUB 101 101 GLY G 100 100 ALA B Protein B 1 FT #SUB 102 102 ILE G 97 97 VAL B Protein A 3 FT #SUB 102 102 ILE G 102 102 ILE B Protein S 3 FT #SUB 105 105 LEU G 97 97 VAL B Protein S 3 FT #SUB 233 233 TRP G 90 90 ARG B Protein S 1 FT #SUB 233 233 TRP G 95 95 GLN B Protein S 2 FT #SUB 233 233 TRP G 261 261 ASP B Protein S 5 FT #SUB 234 234 TYR G 95 95 GLN B Protein S 2 FT #SUB 234 234 TYR G 99 99 ARG B Protein S 1 FT #SUB 235 235 ASP G 99 99 ARG B Protein S 9 FT #SUB 235 235 ASP G 261 261 ASP B Protein A 3 FT #SUB 236 236 ASP G 264 264 ARG B Protein S 3 FT #SUB 238 238 THR G 264 264 ARG B Protein S 4 FT #SUB 255 255 GLU G 96 96 TRP B Protein S 2 FT #SUB 256 256 GLN G 96 96 TRP B Protein S 3 FT #SUB 256 256 GLN G 99 99 ARG B Protein A 8 FT #SUB 258 258 TYR G 97 97 VAL B Protein S 2 FT #SUB 258 258 TYR G 98 98 GLY B Protein S 6 FT #SUB 258 258 TYR G 99 99 ARG B Protein S 1 FT #SUB 261 261 ASP G 233 233 TRP B Protein S 6 FT #SUB 261 261 ASP G 235 235 ASP B Protein S 3 FT #SUB 264 264 ARG G 236 236 ASP B Protein S 3 FT #SUB 264 264 ARG G 238 238 THR B Protein S 4 FT #SUB 281 281 ARG G 96 96 TRP B Protein S 9 FT #SUB 181 181 ASN G 224 224 ASP C Protein S 1 FT #SUB 209 209 ASP G 299 299 ARG C Protein S 1 FT #SUB 209 209 ASP G 301 301 PRO C Protein S 3 FT #SUB 211 211 PRO G 250 250 PRO C Protein A 4 FT #SUB 211 211 PRO G 273 273 ALA C Protein S 1 FT #SUB 211 211 PRO G 274 274 TYR C Protein S 7 FT #SUB 211 211 PRO G 301 301 PRO C Protein S 1 FT #SUB 212 212 THR G 274 274 TYR C Protein S 1 FT #SUB 214 214 GLN G 247 247 THR C Protein S 1 FT #SUB 214 214 GLN G 248 248 SER C Protein A 5 FT #SUB 215 215 ARG G 225 225 ILE C Protein S 1 FT #SUB 215 215 ARG G 226 226 TYR C Protein S 16 FT #SUB 215 215 ARG G 250 250 PRO C Protein S 4 FT #SUB 215 215 ARG G 274 274 TYR C Protein S 4 FT #SUB 218 218 ALA G 248 248 SER C Protein S 2 FT #SUB 221 221 LYS G 222 222 ASP C Protein S 1 FT #SUB 233 233 TRP G 299 299 ARG C Protein S 3 FT #SUB 236 236 ASP G 298 298 HIS C Protein S 1 FT #SUB 236 236 ASP G 299 299 ARG C Protein S 2 FT #SUB 239 239 SER G 298 298 HIS C Protein S 1 FT #SUB 242 242 ARG G 268 268 ASP C Protein S 1 FT #SUB 242 242 ARG G 270 270 GLY C Protein S 6 FT #SUB 246 246 ASN G 244 244 ALA C Protein S 1 FT #SUB 246 246 ASN G 247 247 THR C Protein S 3 FT #SUB 246 246 ASN G 248 248 SER C Protein S 3 FT #SUB 77 77 ASP G 128 128 HIS E Protein S 1 FT #SUB 79 79 SER G 128 128 HIS E Protein S 2 FT #SUB 79 79 SER G 131 131 GLY E Protein B 1 FT #SUB 80 80 ASP G 128 128 HIS E Protein S 2 FT #SUB 80 80 ASP G 131 131 GLY E Protein A 6 FT #SUB 80 80 ASP G 132 132 GLY E Protein S 1 FT #SUB 81 81 HIS G 130 130 LEU E Protein S 2 FT #SUB 81 81 HIS G 131 131 GLY E Protein A 4 FT #SUB 82 82 SER G 130 130 LEU E Protein S 1 FT #SUB 82 82 SER G 131 131 GLY E Protein A 10 FT #SUB 82 82 SER G 319 319 TRP E Protein S 4 FT #SUB 83 83 ARG G 131 131 GLY E Protein B 1 FT #SUB 83 83 ARG G 133 133 ALA E Protein S 3 FT #SUB 90 90 ARG G 299 299 ARG E Protein S 1 FT #SUB 128 128 HIS G 77 77 ASP E Protein S 1 FT #SUB 128 128 HIS G 79 79 SER E Protein S 1 FT #SUB 128 128 HIS G 80 80 ASP E Protein S 2 FT #SUB 129 129 TYR G 129 129 TYR E Protein S 7 FT #SUB 130 130 LEU G 81 81 HIS E Protein B 2 FT #SUB 130 130 LEU G 82 82 SER E Protein B 1 FT #SUB 131 131 GLY G 80 80 ASP E Protein B 5 FT #SUB 131 131 GLY G 81 81 HIS E Protein B 3 FT #SUB 131 131 GLY G 82 82 SER E Protein B 9 FT #SUB 131 131 GLY G 83 83 ARG E Protein B 1 FT #SUB 132 132 GLY G 80 80 ASP E Protein B 1 FT #SUB 133 133 ALA G 83 83 ARG E Protein B 3 FT #SUB 260 260 VAL G 296 296 LEU E Protein S 1 FT #SUB 260 260 VAL G 297 297 ALA E Protein S 2 FT #SUB 260 260 VAL G 299 299 ARG E Protein S 1 FT #SUB 261 261 ASP G 299 299 ARG E Protein S 10 FT #SUB 264 264 ARG G 297 297 ALA E Protein S 4 FT #SUB 264 264 ARG G 298 298 HIS E Protein S 12 FT #SUB 268 268 ASP G 268 268 ASP E Protein S 1 FT #SUB 268 268 ASP G 298 298 HIS E Protein S 5 FT #SUB 289 289 ILE G 293 293 ASP E Protein B 1 FT #SUB 290 290 GLN G 293 293 ASP E Protein A 4 FT #SUB 290 290 GLN G 296 296 LEU E Protein S 3 FT #SUB 293 293 ASP G 290 290 GLN E Protein S 3 FT #SUB 293 293 ASP G 293 293 ASP E Protein S 6 FT #SUB 294 294 LEU G 294 294 LEU E Protein S 1 FT #SUB 296 296 LEU G 290 290 GLN E Protein S 2 FT #SUB 297 297 ALA G 260 260 VAL E Protein A 2 FT #SUB 297 297 ALA G 264 264 ARG E Protein B 4 FT #SUB 297 297 ALA G 294 294 LEU E Protein S 1 FT #SUB 298 298 HIS G 264 264 ARG E Protein A 12 FT #SUB 298 298 HIS G 268 268 ASP E Protein S 2 FT #SUB 299 299 ARG G 90 90 ARG E Protein S 1 FT #SUB 299 299 ARG G 260 260 VAL E Protein S 1 FT #SUB 299 299 ARG G 261 261 ASP E Protein S 10 FT #SUB 319 319 TRP G 82 82 SER E Protein S 3 FT #SUB 224 224 ASP G 181 181 ASN H Protein S 2 FT #SUB 225 225 ILE G 215 215 ARG H Protein B 1 FT #SUB 226 226 TYR G 215 215 ARG H Protein A 14 FT #SUB 244 244 ALA G 246 246 ASN H Protein B 1 FT #SUB 245 245 ARG G 242 242 ARG H Protein S 2 FT #SUB 247 247 THR G 214 214 GLN H Protein B 1 FT #SUB 247 247 THR G 246 246 ASN H Protein B 3 FT #SUB 248 248 SER G 214 214 GLN H Protein A 5 FT #SUB 248 248 SER G 218 218 ALA H Protein S 2 FT #SUB 248 248 SER G 246 246 ASN H Protein A 2 FT #SUB 250 250 PRO G 211 211 PRO H Protein S 4 FT #SUB 250 250 PRO G 215 215 ARG H Protein S 3 FT #SUB 268 268 ASP G 242 242 ARG H Protein B 1 FT #SUB 269 269 ALA G 242 242 ARG H Protein B 1 FT #SUB 270 270 GLY G 242 242 ARG H Protein B 5 FT #SUB 274 274 TYR G 211 211 PRO H Protein S 6 FT #SUB 274 274 TYR G 212 212 THR H Protein S 1 FT #SUB 274 274 TYR G 215 215 ARG H Protein S 3 FT #SUB 298 298 HIS G 236 236 ASP H Protein B 1 FT #SUB 298 298 HIS G 239 239 SER H Protein B 1 FT #SUB 299 299 ARG G 233 233 TRP H Protein S 3 FT #SUB 299 299 ARG G 236 236 ASP H Protein S 2 FT #SUB 301 301 PRO G 209 209 ASP H Protein S 3 FT #SUB 136 136 ALA G 362 362 GLU N Protein A 4 FT #SUB 343 343 ARG G 364 364 PHE N Protein S 2 FT #SUB 343 343 ARG G 368 368 GLY N Protein S 7 FT #SUB 346 346 VAL G 365 365 THR N Protein S 1 FT #SUB 347 347 TYR G 365 365 THR N Protein B 1 FT #SUB 348 348 LYS G 365 365 THR N Protein B 1 FT #SUB 348 348 LYS G 366 366 ARG N Protein S 2 FT #SUB 351 351 GLU G 366 366 ARG N Protein S 9 FT #HET 22 22 ASP G 63 409 0YR G S 10 FT #HET 25 25 HIS G 63 409 0YR G S 3 FT #HET 30 30 TRP G 63 409 0YR G S 2 FT #HET 52 52 HIS G 63 409 0YR G S 6 FT #HET 68 68 CYS G 18 408 GOL B B 4 FT #HET 71 71 PRO G 18 408 GOL B S 2 FT #HET 72 72 LEU G 18 408 GOL B S 2 FT #HET 90 90 ARG G 62 408 GOL G S 8 FT #HET 91 91 TYR G 18 408 GOL B S 5 FT #HET 96 96 TRP G 19 409 0YR B S 3 FT #HET 97 97 VAL G 57 403 CL G B 2 FT #HET 98 98 GLY G 57 403 CL G B 1 FT #HET 100 100 ALA G 57 403 CL G B 1 FT #HET 101 101 GLY G 13 403 CL B B 2 FT #HET 101 101 GLY G 57 403 CL G B 1 FT #HET 102 102 ILE G 13 403 CL B A 2 FT #HET 102 102 ILE G 57 403 CL G B 3 FT #HET 103 103 THR G 57 403 CL G A 4 FT #HET 134 134 ARG G 61 407 GOL G S 6 FT #HET 135 135 THR G 61 407 GOL G S 3 FT #HET 137 137 GLY G 61 407 GOL G B 4 FT #HET 138 138 VAL G 61 407 GOL G B 2 FT #HET 139 139 GLU G 61 407 GOL G A 9 FT #HET 147 147 TRP G 63 409 0YR G S 1 FT #HET 172 172 LYS G 59 405 MG G S 1 FT #HET 172 172 LYS G 63 409 0YR G S 3 FT #HET 174 174 LYS G 63 409 0YR G S 8 FT #HET 180 180 PRO G 60 406 GOL G S 5 FT #HET 181 181 ASN G 60 406 GOL G A 8 FT #HET 184 184 ILE G 60 406 GOL G S 1 FT #HET 203 203 ASP G 59 405 MG G S 3 FT #HET 203 203 ASP G 63 409 0YR G S 5 FT #HET 205 205 ASN G 63 409 0YR G S 7 FT #HET 215 215 ARG G 60 406 GOL G A 12 FT #HET 216 216 PHE G 60 406 GOL G B 1 FT #HET 219 219 ALA G 60 406 GOL G S 2 FT #HET 224 224 ASP G 69 406 GOL H S 5 FT #HET 226 226 TYR G 56 402 CL G S 3 FT #HET 229 229 GLU G 59 405 MG G S 4 FT #HET 229 229 GLU G 63 409 0YR G S 2 FT #HET 233 233 TRP G 17 407 GOL B S 4 FT #HET 255 255 GLU G 59 405 MG G S 3 FT #HET 255 255 GLU G 63 409 0YR G S 10 FT #HET 268 268 ASP G 55 401 CA G S 3 FT #HET 274 274 TYR G 56 402 CL G S 1 FT #HET 298 298 HIS G 55 401 CA G S 2 FT #HET 299 299 ARG G 45 407 GOL E S 6 FT #HET 305 305 HIS G 63 409 0YR G S 9 FT #HET 309 309 MET G 58 404 CL G S 1 FT #HET 323 323 SER G 61 407 GOL G B 1 FT #HET 324 324 THR G 56 402 CL G S 2 FT #HET 324 324 THR G 61 407 GOL G A 8 FT #HET 325 325 ILE G 56 402 CL G S 1 FT #HET 325 325 ILE G 61 407 GOL G A 2 FT #HET 327 327 GLU G 63 409 0YR G S 4 FT #HET 329 329 ILE G 58 404 CL G B 2 FT #HET 330 330 PRO G 58 404 CL G B 3 FT #HET 331 331 TRP G 58 404 CL G B 3 FT #HET 332 332 ILE G 58 404 CL G A 4 FT #HET 333 333 LYS G 58 404 CL G A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19H STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 24 24 THR H 92 92 PRO E Protein B 2 FT #SUB 25 25 HIS H 92 92 PRO E Protein S 5 FT #SUB 25 25 HIS H 96 96 TRP E Protein S 1 FT #SUB 30 30 TRP H 96 96 TRP E Protein S 1 FT #SUB 50 50 GLY H 96 96 TRP E Protein B 4 FT #SUB 51 51 THR H 96 96 TRP E Protein B 2 FT #SUB 52 52 HIS H 93 93 SER E Protein S 1 FT #SUB 52 52 HIS H 96 96 TRP E Protein A 12 FT #SUB 54 54 HIS H 68 68 CYS E Protein S 1 FT #SUB 54 54 HIS H 93 93 SER E Protein S 4 FT #SUB 54 54 HIS H 94 94 LEU E Protein S 2 FT #SUB 56 56 PRO H 67 67 ASP E Protein S 4 FT #SUB 56 56 PRO H 68 68 CYS E Protein A 2 FT #SUB 57 57 SER H 68 68 CYS E Protein A 2 FT #SUB 57 57 SER H 94 94 LEU E Protein S 2 FT #SUB 60 60 LEU H 60 60 LEU E Protein A 2 FT #SUB 60 60 LEU H 63 63 SER E Protein S 1 FT #SUB 60 60 LEU H 64 64 CYS E Protein S 2 FT #SUB 63 63 SER H 60 60 LEU E Protein S 1 FT #SUB 64 64 CYS H 60 60 LEU E Protein A 2 FT #SUB 67 67 ASP H 56 56 PRO E Protein A 3 FT #SUB 68 68 CYS H 54 54 HIS E Protein S 1 FT #SUB 68 68 CYS H 56 56 PRO E Protein S 2 FT #SUB 68 68 CYS H 57 57 SER E Protein S 1 FT #SUB 90 90 ARG H 233 233 TRP E Protein S 3 FT #SUB 92 92 PRO H 24 24 THR E Protein S 2 FT #SUB 92 92 PRO H 25 25 HIS E Protein A 6 FT #SUB 93 93 SER H 54 54 HIS E Protein S 4 FT #SUB 94 94 LEU H 54 54 HIS E Protein S 2 FT #SUB 94 94 LEU H 57 57 SER E Protein S 2 FT #SUB 95 95 GLN H 233 233 TRP E Protein S 2 FT #SUB 95 95 GLN H 234 234 TYR E Protein S 2 FT #SUB 96 96 TRP H 25 25 HIS E Protein S 1 FT #SUB 96 96 TRP H 50 50 GLY E Protein S 4 FT #SUB 96 96 TRP H 51 51 THR E Protein S 2 FT #SUB 96 96 TRP H 52 52 HIS E Protein S 9 FT #SUB 96 96 TRP H 255 255 GLU E Protein S 2 FT #SUB 96 96 TRP H 256 256 GLN E Protein S 3 FT #SUB 96 96 TRP H 281 281 ARG E Protein A 8 FT #SUB 97 97 VAL H 101 101 GLY E Protein B 1 FT #SUB 97 97 VAL H 102 102 ILE E Protein A 4 FT #SUB 97 97 VAL H 105 105 LEU E Protein A 3 FT #SUB 97 97 VAL H 258 258 TYR E Protein B 3 FT #SUB 98 98 GLY H 258 258 TYR E Protein B 6 FT #SUB 99 99 ARG H 234 234 TYR E Protein S 1 FT #SUB 99 99 ARG H 235 235 ASP E Protein S 9 FT #SUB 99 99 ARG H 256 256 GLN E Protein S 7 FT #SUB 99 99 ARG H 258 258 TYR E Protein S 1 FT #SUB 100 100 ALA H 100 100 ALA E Protein S 1 FT #SUB 100 100 ALA H 101 101 GLY E Protein B 1 FT #SUB 101 101 GLY H 97 97 VAL E Protein B 1 FT #SUB 101 101 GLY H 100 100 ALA E Protein B 1 FT #SUB 102 102 ILE H 97 97 VAL E Protein A 4 FT #SUB 102 102 ILE H 102 102 ILE E Protein S 2 FT #SUB 105 105 LEU H 97 97 VAL E Protein S 3 FT #SUB 233 233 TRP H 90 90 ARG E Protein S 4 FT #SUB 233 233 TRP H 95 95 GLN E Protein S 1 FT #SUB 233 233 TRP H 261 261 ASP E Protein S 6 FT #SUB 234 234 TYR H 95 95 GLN E Protein S 2 FT #SUB 234 234 TYR H 99 99 ARG E Protein S 1 FT #SUB 235 235 ASP H 99 99 ARG E Protein S 9 FT #SUB 235 235 ASP H 261 261 ASP E Protein A 3 FT #SUB 236 236 ASP H 264 264 ARG E Protein S 3 FT #SUB 238 238 THR H 264 264 ARG E Protein S 3 FT #SUB 255 255 GLU H 96 96 TRP E Protein S 2 FT #SUB 256 256 GLN H 96 96 TRP E Protein S 3 FT #SUB 256 256 GLN H 99 99 ARG E Protein A 7 FT #SUB 258 258 TYR H 97 97 VAL E Protein S 2 FT #SUB 258 258 TYR H 98 98 GLY E Protein S 6 FT #SUB 258 258 TYR H 99 99 ARG E Protein S 1 FT #SUB 261 261 ASP H 233 233 TRP E Protein S 6 FT #SUB 261 261 ASP H 235 235 ASP E Protein S 3 FT #SUB 264 264 ARG H 236 236 ASP E Protein S 3 FT #SUB 264 264 ARG H 238 238 THR E Protein S 3 FT #SUB 281 281 ARG H 96 96 TRP E Protein S 7 FT #SUB 181 181 ASN H 224 224 ASP G Protein S 2 FT #SUB 209 209 ASP H 301 301 PRO G Protein S 3 FT #SUB 211 211 PRO H 250 250 PRO G Protein A 4 FT #SUB 211 211 PRO H 274 274 TYR G Protein S 6 FT #SUB 212 212 THR H 274 274 TYR G Protein S 1 FT #SUB 214 214 GLN H 247 247 THR G Protein S 1 FT #SUB 214 214 GLN H 248 248 SER G Protein A 5 FT #SUB 215 215 ARG H 225 225 ILE G Protein S 1 FT #SUB 215 215 ARG H 226 226 TYR G Protein S 14 FT #SUB 215 215 ARG H 250 250 PRO G Protein S 3 FT #SUB 215 215 ARG H 274 274 TYR G Protein S 3 FT #SUB 218 218 ALA H 248 248 SER G Protein S 2 FT #SUB 233 233 TRP H 299 299 ARG G Protein S 3 FT #SUB 236 236 ASP H 298 298 HIS G Protein S 1 FT #SUB 236 236 ASP H 299 299 ARG G Protein S 2 FT #SUB 239 239 SER H 298 298 HIS G Protein S 1 FT #SUB 242 242 ARG H 245 245 ARG G Protein S 2 FT #SUB 242 242 ARG H 268 268 ASP G Protein S 1 FT #SUB 242 242 ARG H 269 269 ALA G Protein S 1 FT #SUB 242 242 ARG H 270 270 GLY G Protein S 5 FT #SUB 246 246 ASN H 244 244 ALA G Protein S 1 FT #SUB 246 246 ASN H 247 247 THR G Protein S 3 FT #SUB 246 246 ASN H 248 248 SER G Protein S 2 FT #SUB 77 77 ASP H 128 128 HIS I Protein S 1 FT #SUB 79 79 SER H 128 128 HIS I Protein S 1 FT #SUB 79 79 SER H 131 131 GLY I Protein B 1 FT #SUB 80 80 ASP H 128 128 HIS I Protein S 2 FT #SUB 80 80 ASP H 131 131 GLY I Protein A 5 FT #SUB 80 80 ASP H 132 132 GLY I Protein S 1 FT #SUB 81 81 HIS H 130 130 LEU I Protein S 2 FT #SUB 81 81 HIS H 131 131 GLY I Protein A 4 FT #SUB 82 82 SER H 130 130 LEU I Protein S 1 FT #SUB 82 82 SER H 131 131 GLY I Protein A 7 FT #SUB 82 82 SER H 319 319 TRP I Protein S 3 FT #SUB 83 83 ARG H 131 131 GLY I Protein B 1 FT #SUB 83 83 ARG H 133 133 ALA I Protein S 3 FT #SUB 90 90 ARG H 299 299 ARG I Protein S 1 FT #SUB 128 128 HIS H 77 77 ASP I Protein S 1 FT #SUB 128 128 HIS H 79 79 SER I Protein S 2 FT #SUB 128 128 HIS H 80 80 ASP I Protein S 2 FT #SUB 129 129 TYR H 118 118 LYS I Protein B 2 FT #SUB 129 129 TYR H 129 129 TYR I Protein S 6 FT #SUB 130 130 LEU H 81 81 HIS I Protein B 2 FT #SUB 130 130 LEU H 82 82 SER I Protein B 1 FT #SUB 131 131 GLY H 79 79 SER I Protein B 1 FT #SUB 131 131 GLY H 80 80 ASP I Protein B 5 FT #SUB 131 131 GLY H 81 81 HIS I Protein B 4 FT #SUB 131 131 GLY H 82 82 SER I Protein B 9 FT #SUB 131 131 GLY H 83 83 ARG I Protein B 1 FT #SUB 132 132 GLY H 80 80 ASP I Protein B 1 FT #SUB 133 133 ALA H 83 83 ARG I Protein B 3 FT #SUB 260 260 VAL H 297 297 ALA I Protein S 2 FT #SUB 260 260 VAL H 299 299 ARG I Protein S 1 FT #SUB 261 261 ASP H 299 299 ARG I Protein S 10 FT #SUB 264 264 ARG H 297 297 ALA I Protein S 4 FT #SUB 264 264 ARG H 298 298 HIS I Protein S 11 FT #SUB 268 268 ASP H 268 268 ASP I Protein S 1 FT #SUB 268 268 ASP H 298 298 HIS I Protein S 2 FT #SUB 289 289 ILE H 293 293 ASP I Protein B 1 FT #SUB 290 290 GLN H 293 293 ASP I Protein A 4 FT #SUB 290 290 GLN H 296 296 LEU I Protein S 3 FT #SUB 293 293 ASP H 289 289 ILE I Protein S 1 FT #SUB 293 293 ASP H 290 290 GLN I Protein S 4 FT #SUB 293 293 ASP H 293 293 ASP I Protein S 6 FT #SUB 294 294 LEU H 294 294 LEU I Protein S 1 FT #SUB 294 294 LEU H 297 297 ALA I Protein S 1 FT #SUB 296 296 LEU H 260 260 VAL I Protein S 1 FT #SUB 296 296 LEU H 290 290 GLN I Protein S 3 FT #SUB 297 297 ALA H 260 260 VAL I Protein A 2 FT #SUB 297 297 ALA H 264 264 ARG I Protein B 4 FT #SUB 297 297 ALA H 294 294 LEU I Protein S 2 FT #SUB 298 298 HIS H 264 264 ARG I Protein A 12 FT #SUB 298 298 HIS H 268 268 ASP I Protein S 2 FT #SUB 299 299 ARG H 90 90 ARG I Protein S 1 FT #SUB 299 299 ARG H 260 260 VAL I Protein S 1 FT #SUB 299 299 ARG H 261 261 ASP I Protein S 10 FT #SUB 319 319 TRP H 82 82 SER I Protein S 3 FT #SUB 224 224 ASP H 181 181 ASN L Protein S 2 FT #SUB 225 225 ILE H 215 215 ARG L Protein B 1 FT #SUB 226 226 TYR H 215 215 ARG L Protein A 15 FT #SUB 244 244 ALA H 246 246 ASN L Protein B 1 FT #SUB 245 245 ARG H 242 242 ARG L Protein S 1 FT #SUB 247 247 THR H 214 214 GLN L Protein B 1 FT #SUB 247 247 THR H 246 246 ASN L Protein B 2 FT #SUB 248 248 SER H 214 214 GLN L Protein A 5 FT #SUB 248 248 SER H 218 218 ALA L Protein S 2 FT #SUB 248 248 SER H 246 246 ASN L Protein A 2 FT #SUB 250 250 PRO H 211 211 PRO L Protein S 4 FT #SUB 250 250 PRO H 215 215 ARG L Protein S 4 FT #SUB 268 268 ASP H 242 242 ARG L Protein B 1 FT #SUB 270 270 GLY H 242 242 ARG L Protein B 6 FT #SUB 273 273 ALA H 211 211 PRO L Protein S 1 FT #SUB 274 274 TYR H 211 211 PRO L Protein S 6 FT #SUB 274 274 TYR H 212 212 THR L Protein S 1 FT #SUB 274 274 TYR H 215 215 ARG L Protein S 4 FT #SUB 298 298 HIS H 236 236 ASP L Protein B 1 FT #SUB 298 298 HIS H 239 239 SER L Protein B 1 FT #SUB 299 299 ARG H 233 233 TRP L Protein S 3 FT #SUB 299 299 ARG H 236 236 ASP L Protein S 2 FT #SUB 301 301 PRO H 209 209 ASP L Protein S 3 FT #SUB 151 151 THR H 41 41 ASP N Protein S 2 FT #HET 22 22 ASP H 72 409 0YR H S 9 FT #HET 25 25 HIS H 72 409 0YR H S 3 FT #HET 30 30 TRP H 72 409 0YR H S 2 FT #HET 52 52 HIS H 72 409 0YR H S 5 FT #HET 90 90 ARG H 71 408 GOL H S 8 FT #HET 96 96 TRP H 46 408 0YR E S 3 FT #HET 97 97 VAL H 66 403 CL H B 2 FT #HET 98 98 GLY H 66 403 CL H B 1 FT #HET 100 100 ALA H 66 403 CL H B 2 FT #HET 101 101 GLY H 40 402 CL E B 2 FT #HET 101 101 GLY H 66 403 CL H B 1 FT #HET 102 102 ILE H 40 402 CL E A 2 FT #HET 102 102 ILE H 66 403 CL H B 1 FT #HET 103 103 THR H 66 403 CL H A 5 FT #HET 147 147 TRP H 72 409 0YR H S 1 FT #HET 172 172 LYS H 68 405 MG H S 1 FT #HET 172 172 LYS H 72 409 0YR H S 3 FT #HET 174 174 LYS H 72 409 0YR H S 8 FT #HET 180 180 PRO H 69 406 GOL H S 5 FT #HET 181 181 ASN H 69 406 GOL H A 7 FT #HET 184 184 ILE H 69 406 GOL H S 1 FT #HET 203 203 ASP H 68 405 MG H S 3 FT #HET 203 203 ASP H 72 409 0YR H S 5 FT #HET 205 205 ASN H 72 409 0YR H S 7 FT #HET 215 215 ARG H 69 406 GOL H A 14 FT #HET 216 216 PHE H 69 406 GOL H B 2 FT #HET 219 219 ALA H 69 406 GOL H S 2 FT #HET 224 224 ASP H 92 405 GOL L S 5 FT #HET 226 226 TYR H 65 402 CL H S 3 FT #HET 229 229 GLU H 68 405 MG H S 4 FT #HET 229 229 GLU H 72 409 0YR H S 2 FT #HET 233 233 TRP H 45 407 GOL E S 6 FT #HET 255 255 GLU H 68 405 MG H S 3 FT #HET 255 255 GLU H 72 409 0YR H S 10 FT #HET 268 268 ASP H 64 401 CA H S 3 FT #HET 274 274 TYR H 65 402 CL H S 1 FT #HET 298 298 HIS H 64 401 CA H S 3 FT #HET 299 299 ARG H 70 407 GOL H S 5 FT #HET 305 305 HIS H 72 409 0YR H S 9 FT #HET 309 309 MET H 67 404 CL H S 1 FT #HET 324 324 THR H 65 402 CL H S 3 FT #HET 325 325 ILE H 65 402 CL H S 1 FT #HET 327 327 GLU H 72 409 0YR H S 4 FT #HET 329 329 ILE H 67 404 CL H B 2 FT #HET 330 330 PRO H 67 404 CL H B 3 FT #HET 331 331 TRP H 67 404 CL H B 3 FT #HET 332 332 ILE H 67 404 CL H A 4 FT #HET 333 333 LYS H 67 404 CL H A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19I STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 222 222 ASP I 221 221 LYS E Protein S 1 FT #SUB 224 224 ASP I 181 181 ASN E Protein S 1 FT #SUB 225 225 ILE I 215 215 ARG E Protein B 1 FT #SUB 226 226 TYR I 215 215 ARG E Protein A 16 FT #SUB 244 244 ALA I 246 246 ASN E Protein B 1 FT #SUB 245 245 ARG I 242 242 ARG E Protein S 1 FT #SUB 247 247 THR I 214 214 GLN E Protein B 1 FT #SUB 247 247 THR I 246 246 ASN E Protein B 2 FT #SUB 248 248 SER I 214 214 GLN E Protein B 4 FT #SUB 248 248 SER I 218 218 ALA E Protein S 2 FT #SUB 248 248 SER I 246 246 ASN E Protein A 3 FT #SUB 250 250 PRO I 211 211 PRO E Protein S 4 FT #SUB 250 250 PRO I 215 215 ARG E Protein S 2 FT #SUB 267 267 ILE I 242 242 ARG E Protein B 1 FT #SUB 268 268 ASP I 242 242 ARG E Protein B 1 FT #SUB 270 270 GLY I 242 242 ARG E Protein B 6 FT #SUB 273 273 ALA I 211 211 PRO E Protein S 1 FT #SUB 274 274 TYR I 211 211 PRO E Protein S 6 FT #SUB 274 274 TYR I 215 215 ARG E Protein S 3 FT #SUB 298 298 HIS I 236 236 ASP E Protein B 1 FT #SUB 298 298 HIS I 239 239 SER E Protein B 1 FT #SUB 299 299 ARG I 209 209 ASP E Protein B 1 FT #SUB 299 299 ARG I 233 233 TRP E Protein S 3 FT #SUB 299 299 ARG I 236 236 ASP E Protein S 2 FT #SUB 301 301 PRO I 209 209 ASP E Protein S 3 FT #SUB 77 77 ASP I 128 128 HIS H Protein S 1 FT #SUB 79 79 SER I 128 128 HIS H Protein S 2 FT #SUB 79 79 SER I 131 131 GLY H Protein B 1 FT #SUB 80 80 ASP I 128 128 HIS H Protein S 2 FT #SUB 80 80 ASP I 131 131 GLY H Protein A 5 FT #SUB 80 80 ASP I 132 132 GLY H Protein S 1 FT #SUB 81 81 HIS I 130 130 LEU H Protein S 2 FT #SUB 81 81 HIS I 131 131 GLY H Protein A 4 FT #SUB 82 82 SER I 130 130 LEU H Protein S 1 FT #SUB 82 82 SER I 131 131 GLY H Protein A 9 FT #SUB 82 82 SER I 319 319 TRP H Protein S 3 FT #SUB 83 83 ARG I 131 131 GLY H Protein B 1 FT #SUB 83 83 ARG I 133 133 ALA H Protein S 3 FT #SUB 90 90 ARG I 299 299 ARG H Protein S 1 FT #SUB 118 118 LYS I 129 129 TYR H Protein S 2 FT #SUB 128 128 HIS I 77 77 ASP H Protein S 1 FT #SUB 128 128 HIS I 79 79 SER H Protein S 1 FT #SUB 128 128 HIS I 80 80 ASP H Protein S 2 FT #SUB 129 129 TYR I 129 129 TYR H Protein S 6 FT #SUB 130 130 LEU I 81 81 HIS H Protein B 2 FT #SUB 130 130 LEU I 82 82 SER H Protein B 1 FT #SUB 131 131 GLY I 79 79 SER H Protein B 1 FT #SUB 131 131 GLY I 80 80 ASP H Protein B 5 FT #SUB 131 131 GLY I 81 81 HIS H Protein B 4 FT #SUB 131 131 GLY I 82 82 SER H Protein B 7 FT #SUB 131 131 GLY I 83 83 ARG H Protein B 1 FT #SUB 132 132 GLY I 80 80 ASP H Protein B 1 FT #SUB 133 133 ALA I 83 83 ARG H Protein B 3 FT #SUB 260 260 VAL I 296 296 LEU H Protein S 1 FT #SUB 260 260 VAL I 297 297 ALA H Protein S 2 FT #SUB 260 260 VAL I 299 299 ARG H Protein S 1 FT #SUB 261 261 ASP I 299 299 ARG H Protein S 10 FT #SUB 264 264 ARG I 297 297 ALA H Protein S 4 FT #SUB 264 264 ARG I 298 298 HIS H Protein S 12 FT #SUB 268 268 ASP I 268 268 ASP H Protein S 1 FT #SUB 268 268 ASP I 298 298 HIS H Protein S 2 FT #SUB 289 289 ILE I 293 293 ASP H Protein B 1 FT #SUB 290 290 GLN I 293 293 ASP H Protein A 4 FT #SUB 290 290 GLN I 296 296 LEU H Protein S 3 FT #SUB 293 293 ASP I 289 289 ILE H Protein S 1 FT #SUB 293 293 ASP I 290 290 GLN H Protein S 4 FT #SUB 293 293 ASP I 293 293 ASP H Protein S 6 FT #SUB 294 294 LEU I 294 294 LEU H Protein S 1 FT #SUB 294 294 LEU I 297 297 ALA H Protein S 2 FT #SUB 296 296 LEU I 290 290 GLN H Protein S 3 FT #SUB 297 297 ALA I 260 260 VAL H Protein A 2 FT #SUB 297 297 ALA I 264 264 ARG H Protein B 4 FT #SUB 297 297 ALA I 294 294 LEU H Protein S 1 FT #SUB 298 298 HIS I 264 264 ARG H Protein A 11 FT #SUB 298 298 HIS I 268 268 ASP H Protein S 2 FT #SUB 299 299 ARG I 90 90 ARG H Protein S 1 FT #SUB 299 299 ARG I 260 260 VAL H Protein S 1 FT #SUB 299 299 ARG I 261 261 ASP H Protein S 10 FT #SUB 319 319 TRP I 82 82 SER H Protein S 3 FT #SUB 24 24 THR I 92 92 PRO L Protein B 1 FT #SUB 25 25 HIS I 92 92 PRO L Protein S 5 FT #SUB 25 25 HIS I 96 96 TRP L Protein S 3 FT #SUB 30 30 TRP I 96 96 TRP L Protein S 1 FT #SUB 50 50 GLY I 96 96 TRP L Protein B 4 FT #SUB 51 51 THR I 96 96 TRP L Protein B 2 FT #SUB 52 52 HIS I 96 96 TRP L Protein S 11 FT #SUB 54 54 HIS I 68 68 CYS L Protein S 1 FT #SUB 54 54 HIS I 93 93 SER L Protein S 4 FT #SUB 54 54 HIS I 94 94 LEU L Protein S 2 FT #SUB 56 56 PRO I 67 67 ASP L Protein S 4 FT #SUB 56 56 PRO I 68 68 CYS L Protein A 2 FT #SUB 57 57 SER I 68 68 CYS L Protein B 1 FT #SUB 57 57 SER I 94 94 LEU L Protein S 2 FT #SUB 57 57 SER I 97 97 VAL L Protein S 1 FT #SUB 60 60 LEU I 60 60 LEU L Protein A 2 FT #SUB 60 60 LEU I 63 63 SER L Protein S 1 FT #SUB 60 60 LEU I 64 64 CYS L Protein S 2 FT #SUB 63 63 SER I 60 60 LEU L Protein S 1 FT #SUB 64 64 CYS I 60 60 LEU L Protein A 2 FT #SUB 67 67 ASP I 56 56 PRO L Protein B 2 FT #SUB 68 68 CYS I 56 56 PRO L Protein S 2 FT #SUB 68 68 CYS I 57 57 SER L Protein S 1 FT #SUB 90 90 ARG I 233 233 TRP L Protein S 3 FT #SUB 92 92 PRO I 24 24 THR L Protein S 2 FT #SUB 92 92 PRO I 25 25 HIS L Protein A 6 FT #SUB 93 93 SER I 54 54 HIS L Protein S 5 FT #SUB 94 94 LEU I 54 54 HIS L Protein S 2 FT #SUB 94 94 LEU I 57 57 SER L Protein S 2 FT #SUB 95 95 GLN I 233 233 TRP L Protein S 1 FT #SUB 95 95 GLN I 234 234 TYR L Protein S 2 FT #SUB 96 96 TRP I 25 25 HIS L Protein S 1 FT #SUB 96 96 TRP I 50 50 GLY L Protein S 4 FT #SUB 96 96 TRP I 51 51 THR L Protein S 2 FT #SUB 96 96 TRP I 52 52 HIS L Protein S 9 FT #SUB 96 96 TRP I 255 255 GLU L Protein S 2 FT #SUB 96 96 TRP I 256 256 GLN L Protein S 3 FT #SUB 96 96 TRP I 281 281 ARG L Protein A 8 FT #SUB 97 97 VAL I 101 101 GLY L Protein B 1 FT #SUB 97 97 VAL I 102 102 ILE L Protein A 4 FT #SUB 97 97 VAL I 105 105 LEU L Protein A 3 FT #SUB 97 97 VAL I 258 258 TYR L Protein B 2 FT #SUB 98 98 GLY I 258 258 TYR L Protein B 6 FT #SUB 99 99 ARG I 234 234 TYR L Protein S 2 FT #SUB 99 99 ARG I 235 235 ASP L Protein S 10 FT #SUB 99 99 ARG I 256 256 GLN L Protein S 7 FT #SUB 99 99 ARG I 258 258 TYR L Protein S 1 FT #SUB 100 100 ALA I 100 100 ALA L Protein S 1 FT #SUB 100 100 ALA I 101 101 GLY L Protein B 1 FT #SUB 101 101 GLY I 97 97 VAL L Protein B 1 FT #SUB 101 101 GLY I 100 100 ALA L Protein B 1 FT #SUB 102 102 ILE I 97 97 VAL L Protein A 4 FT #SUB 102 102 ILE I 102 102 ILE L Protein S 3 FT #SUB 105 105 LEU I 97 97 VAL L Protein S 3 FT #SUB 233 233 TRP I 90 90 ARG L Protein S 1 FT #SUB 233 233 TRP I 95 95 GLN L Protein S 1 FT #SUB 233 233 TRP I 99 99 ARG L Protein S 1 FT #SUB 233 233 TRP I 261 261 ASP L Protein S 6 FT #SUB 234 234 TYR I 95 95 GLN L Protein S 2 FT #SUB 234 234 TYR I 99 99 ARG L Protein S 1 FT #SUB 235 235 ASP I 99 99 ARG L Protein S 9 FT #SUB 235 235 ASP I 261 261 ASP L Protein A 3 FT #SUB 236 236 ASP I 264 264 ARG L Protein S 3 FT #SUB 238 238 THR I 264 264 ARG L Protein S 3 FT #SUB 255 255 GLU I 96 96 TRP L Protein S 1 FT #SUB 256 256 GLN I 96 96 TRP L Protein S 3 FT #SUB 256 256 GLN I 99 99 ARG L Protein A 6 FT #SUB 258 258 TYR I 97 97 VAL L Protein S 2 FT #SUB 258 258 TYR I 98 98 GLY L Protein S 6 FT #SUB 258 258 TYR I 99 99 ARG L Protein S 1 FT #SUB 261 261 ASP I 233 233 TRP L Protein S 6 FT #SUB 261 261 ASP I 235 235 ASP L Protein S 3 FT #SUB 264 264 ARG I 236 236 ASP L Protein S 3 FT #SUB 264 264 ARG I 238 238 THR L Protein S 4 FT #SUB 281 281 ARG I 96 96 TRP L Protein S 8 FT #SUB 181 181 ASN I 224 224 ASP M Protein S 1 FT #SUB 209 209 ASP I 301 301 PRO M Protein S 3 FT #SUB 211 211 PRO I 250 250 PRO M Protein A 4 FT #SUB 211 211 PRO I 273 273 ALA M Protein S 2 FT #SUB 211 211 PRO I 274 274 TYR M Protein S 6 FT #SUB 211 211 PRO I 301 301 PRO M Protein S 1 FT #SUB 214 214 GLN I 247 247 THR M Protein S 1 FT #SUB 214 214 GLN I 248 248 SER M Protein A 5 FT #SUB 215 215 ARG I 225 225 ILE M Protein S 2 FT #SUB 215 215 ARG I 226 226 TYR M Protein S 18 FT #SUB 215 215 ARG I 250 250 PRO M Protein S 4 FT #SUB 215 215 ARG I 274 274 TYR M Protein S 3 FT #SUB 218 218 ALA I 248 248 SER M Protein S 2 FT #SUB 221 221 LYS I 222 222 ASP M Protein S 1 FT #SUB 233 233 TRP I 299 299 ARG M Protein S 3 FT #SUB 236 236 ASP I 298 298 HIS M Protein S 1 FT #SUB 236 236 ASP I 299 299 ARG M Protein S 2 FT #SUB 239 239 SER I 298 298 HIS M Protein S 1 FT #SUB 242 242 ARG I 245 245 ARG M Protein S 2 FT #SUB 242 242 ARG I 268 268 ASP M Protein S 1 FT #SUB 242 242 ARG I 270 270 GLY M Protein S 5 FT #SUB 246 246 ASN I 244 244 ALA M Protein S 1 FT #SUB 246 246 ASN I 247 247 THR M Protein S 3 FT #SUB 246 246 ASN I 248 248 SER M Protein S 2 FT #HET 22 22 ASP I 78 406 0YR I S 9 FT #HET 25 25 HIS I 78 406 0YR I S 3 FT #HET 30 30 TRP I 78 406 0YR I S 2 FT #HET 52 52 HIS I 78 406 0YR I S 8 FT #HET 90 90 ARG I 70 407 GOL H S 8 FT #HET 96 96 TRP I 94 407 0YR L S 3 FT #HET 97 97 VAL I 74 402 CL I B 1 FT #HET 98 98 GLY I 74 402 CL I B 1 FT #HET 100 100 ALA I 74 402 CL I B 2 FT #HET 101 101 GLY I 74 402 CL I B 1 FT #HET 101 101 GLY I 90 403 CL L B 2 FT #HET 102 102 ILE I 74 402 CL I B 1 FT #HET 102 102 ILE I 90 403 CL L A 2 FT #HET 103 103 THR I 74 402 CL I A 5 FT #HET 147 147 TRP I 78 406 0YR I S 1 FT #HET 172 172 LYS I 76 404 MG I S 1 FT #HET 172 172 LYS I 78 406 0YR I S 3 FT #HET 174 174 LYS I 76 404 MG I S 1 FT #HET 174 174 LYS I 78 406 0YR I S 8 FT #HET 180 180 PRO I 77 405 GOL I S 5 FT #HET 181 181 ASN I 77 405 GOL I S 6 FT #HET 184 184 ILE I 77 405 GOL I S 1 FT #HET 203 203 ASP I 76 404 MG I S 3 FT #HET 203 203 ASP I 78 406 0YR I S 4 FT #HET 205 205 ASN I 76 404 MG I S 1 FT #HET 205 205 ASN I 78 406 0YR I S 5 FT #HET 215 215 ARG I 77 405 GOL I A 14 FT #HET 216 216 PHE I 77 405 GOL I B 1 FT #HET 219 219 ALA I 77 405 GOL I S 2 FT #HET 224 224 ASP I 43 405 GOL E S 5 FT #HET 226 226 TYR I 73 401 CL I S 3 FT #HET 229 229 GLU I 76 404 MG I S 4 FT #HET 229 229 GLU I 78 406 0YR I S 2 FT #HET 255 255 GLU I 76 404 MG I S 3 FT #HET 255 255 GLU I 78 406 0YR I S 10 FT #HET 268 268 ASP I 64 401 CA H S 3 FT #HET 274 274 TYR I 73 401 CL I S 1 FT #HET 298 298 HIS I 64 401 CA H S 3 FT #HET 299 299 ARG I 71 408 GOL H S 4 FT #HET 305 305 HIS I 78 406 0YR I S 9 FT #HET 309 309 MET I 75 403 CL I S 1 FT #HET 324 324 THR I 73 401 CL I S 2 FT #HET 325 325 ILE I 73 401 CL I S 1 FT #HET 327 327 GLU I 78 406 0YR I S 5 FT #HET 329 329 ILE I 75 403 CL I B 2 FT #HET 330 330 PRO I 75 403 CL I B 4 FT #HET 331 331 TRP I 75 403 CL I B 3 FT #HET 332 332 ILE I 75 403 CL I A 4 FT #HET 333 333 LYS I 75 403 CL I A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19K STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 181 181 ASN K 224 224 ASP D Protein S 1 FT #SUB 209 209 ASP K 301 301 PRO D Protein S 3 FT #SUB 211 211 PRO K 250 250 PRO D Protein A 4 FT #SUB 211 211 PRO K 273 273 ALA D Protein S 1 FT #SUB 211 211 PRO K 274 274 TYR D Protein S 6 FT #SUB 214 214 GLN K 247 247 THR D Protein S 1 FT #SUB 214 214 GLN K 248 248 SER D Protein A 6 FT #SUB 215 215 ARG K 225 225 ILE D Protein S 1 FT #SUB 215 215 ARG K 226 226 TYR D Protein S 17 FT #SUB 215 215 ARG K 250 250 PRO D Protein S 3 FT #SUB 215 215 ARG K 274 274 TYR D Protein S 4 FT #SUB 218 218 ALA K 248 248 SER D Protein S 2 FT #SUB 221 221 LYS K 222 222 ASP D Protein S 1 FT #SUB 233 233 TRP K 299 299 ARG D Protein S 3 FT #SUB 236 236 ASP K 298 298 HIS D Protein S 1 FT #SUB 236 236 ASP K 299 299 ARG D Protein S 2 FT #SUB 239 239 SER K 298 298 HIS D Protein S 1 FT #SUB 242 242 ARG K 245 245 ARG D Protein S 2 FT #SUB 242 242 ARG K 268 268 ASP D Protein S 1 FT #SUB 242 242 ARG K 270 270 GLY D Protein S 6 FT #SUB 246 246 ASN K 247 247 THR D Protein S 3 FT #SUB 246 246 ASN K 248 248 SER D Protein S 2 FT #SUB 151 151 THR K 41 41 ASP E Protein S 1 FT #SUB 24 24 THR K 92 92 PRO F Protein B 2 FT #SUB 25 25 HIS K 92 92 PRO F Protein S 5 FT #SUB 25 25 HIS K 96 96 TRP F Protein S 2 FT #SUB 30 30 TRP K 96 96 TRP F Protein S 1 FT #SUB 50 50 GLY K 96 96 TRP F Protein B 4 FT #SUB 51 51 THR K 96 96 TRP F Protein B 2 FT #SUB 52 52 HIS K 96 96 TRP F Protein S 11 FT #SUB 54 54 HIS K 68 68 CYS F Protein S 1 FT #SUB 54 54 HIS K 93 93 SER F Protein S 4 FT #SUB 54 54 HIS K 94 94 LEU F Protein S 1 FT #SUB 56 56 PRO K 67 67 ASP F Protein S 4 FT #SUB 56 56 PRO K 68 68 CYS F Protein A 2 FT #SUB 57 57 SER K 68 68 CYS F Protein B 2 FT #SUB 57 57 SER K 94 94 LEU F Protein S 1 FT #SUB 57 57 SER K 97 97 VAL F Protein S 1 FT #SUB 60 60 LEU K 60 60 LEU F Protein A 2 FT #SUB 60 60 LEU K 63 63 SER F Protein S 1 FT #SUB 60 60 LEU K 64 64 CYS F Protein S 2 FT #SUB 60 60 LEU K 68 68 CYS F Protein S 1 FT #SUB 63 63 SER K 60 60 LEU F Protein S 1 FT #SUB 64 64 CYS K 60 60 LEU F Protein A 2 FT #SUB 67 67 ASP K 56 56 PRO F Protein A 3 FT #SUB 68 68 CYS K 54 54 HIS F Protein S 1 FT #SUB 68 68 CYS K 56 56 PRO F Protein S 3 FT #SUB 68 68 CYS K 57 57 SER F Protein S 3 FT #SUB 90 90 ARG K 233 233 TRP F Protein S 5 FT #SUB 92 92 PRO K 24 24 THR F Protein S 2 FT #SUB 92 92 PRO K 25 25 HIS F Protein A 6 FT #SUB 93 93 SER K 54 54 HIS F Protein S 4 FT #SUB 94 94 LEU K 54 54 HIS F Protein S 2 FT #SUB 94 94 LEU K 57 57 SER F Protein S 2 FT #SUB 95 95 GLN K 233 233 TRP F Protein S 2 FT #SUB 95 95 GLN K 234 234 TYR F Protein S 2 FT #SUB 96 96 TRP K 25 25 HIS F Protein S 1 FT #SUB 96 96 TRP K 50 50 GLY F Protein S 4 FT #SUB 96 96 TRP K 51 51 THR F Protein S 2 FT #SUB 96 96 TRP K 52 52 HIS F Protein S 7 FT #SUB 96 96 TRP K 255 255 GLU F Protein S 2 FT #SUB 96 96 TRP K 256 256 GLN F Protein S 3 FT #SUB 96 96 TRP K 281 281 ARG F Protein A 8 FT #SUB 97 97 VAL K 101 101 GLY F Protein B 1 FT #SUB 97 97 VAL K 102 102 ILE F Protein A 4 FT #SUB 97 97 VAL K 105 105 LEU F Protein A 3 FT #SUB 97 97 VAL K 258 258 TYR F Protein B 3 FT #SUB 98 98 GLY K 258 258 TYR F Protein B 6 FT #SUB 99 99 ARG K 234 234 TYR F Protein S 1 FT #SUB 99 99 ARG K 235 235 ASP F Protein S 9 FT #SUB 99 99 ARG K 256 256 GLN F Protein S 8 FT #SUB 99 99 ARG K 258 258 TYR F Protein S 1 FT #SUB 100 100 ALA K 100 100 ALA F Protein S 1 FT #SUB 100 100 ALA K 101 101 GLY F Protein B 1 FT #SUB 101 101 GLY K 97 97 VAL F Protein B 1 FT #SUB 101 101 GLY K 100 100 ALA F Protein B 1 FT #SUB 102 102 ILE K 97 97 VAL F Protein A 4 FT #SUB 102 102 ILE K 102 102 ILE F Protein S 3 FT #SUB 105 105 LEU K 97 97 VAL F Protein S 3 FT #SUB 233 233 TRP K 90 90 ARG F Protein S 3 FT #SUB 233 233 TRP K 95 95 GLN F Protein S 1 FT #SUB 233 233 TRP K 261 261 ASP F Protein S 6 FT #SUB 234 234 TYR K 95 95 GLN F Protein S 2 FT #SUB 234 234 TYR K 99 99 ARG F Protein S 2 FT #SUB 235 235 ASP K 99 99 ARG F Protein S 9 FT #SUB 235 235 ASP K 261 261 ASP F Protein A 3 FT #SUB 236 236 ASP K 264 264 ARG F Protein S 3 FT #SUB 238 238 THR K 264 264 ARG F Protein S 4 FT #SUB 255 255 GLU K 96 96 TRP F Protein S 1 FT #SUB 256 256 GLN K 96 96 TRP F Protein S 3 FT #SUB 256 256 GLN K 99 99 ARG F Protein A 7 FT #SUB 258 258 TYR K 97 97 VAL F Protein S 2 FT #SUB 258 258 TYR K 98 98 GLY F Protein S 6 FT #SUB 258 258 TYR K 99 99 ARG F Protein S 1 FT #SUB 261 261 ASP K 233 233 TRP F Protein S 6 FT #SUB 261 261 ASP K 235 235 ASP F Protein S 3 FT #SUB 264 264 ARG K 236 236 ASP F Protein S 3 FT #SUB 264 264 ARG K 238 238 THR F Protein S 4 FT #SUB 281 281 ARG K 96 96 TRP F Protein S 8 FT #SUB 195 195 ASP K 153 153 GLU N Protein S 1 FT #HET 22 22 ASP K 87 409 0YR K S 8 FT #HET 25 25 HIS K 87 409 0YR K S 3 FT #HET 30 30 TRP K 87 409 0YR K S 2 FT #HET 52 52 HIS K 87 409 0YR K S 8 FT #HET 96 96 TRP K 54 408 0YR F S 4 FT #HET 97 97 VAL K 81 403 CL K B 1 FT #HET 98 98 GLY K 81 403 CL K B 1 FT #HET 100 100 ALA K 81 403 CL K B 2 FT #HET 101 101 GLY K 48 402 CL F B 2 FT #HET 101 101 GLY K 81 403 CL K B 1 FT #HET 102 102 ILE K 48 402 CL F A 3 FT #HET 102 102 ILE K 81 403 CL K B 3 FT #HET 103 103 THR K 81 403 CL K A 4 FT #HET 134 134 ARG K 86 408 GOL K S 3 FT #HET 137 137 GLY K 86 408 GOL K B 2 FT #HET 138 138 VAL K 86 408 GOL K B 2 FT #HET 139 139 GLU K 86 408 GOL K A 10 FT #HET 147 147 TRP K 87 409 0YR K S 1 FT #HET 172 172 LYS K 83 405 MG K S 1 FT #HET 172 172 LYS K 87 409 0YR K S 3 FT #HET 174 174 LYS K 87 409 0YR K S 7 FT #HET 180 180 PRO K 84 406 GOL K S 6 FT #HET 181 181 ASN K 84 406 GOL K S 7 FT #HET 184 184 ILE K 84 406 GOL K S 1 FT #HET 203 203 ASP K 83 405 MG K S 3 FT #HET 203 203 ASP K 87 409 0YR K S 4 FT #HET 205 205 ASN K 87 409 0YR K S 7 FT #HET 215 215 ARG K 84 406 GOL K A 14 FT #HET 216 216 PHE K 84 406 GOL K B 1 FT #HET 219 219 ALA K 84 406 GOL K S 2 FT #HET 226 226 TYR K 80 402 CL K S 3 FT #HET 229 229 GLU K 83 405 MG K S 4 FT #HET 229 229 GLU K 87 409 0YR K S 2 FT #HET 255 255 GLU K 83 405 MG K S 3 FT #HET 255 255 GLU K 87 409 0YR K S 10 FT #HET 268 268 ASP K 79 401 CA K S 3 FT #HET 274 274 TYR K 80 402 CL K S 1 FT #HET 298 298 HIS K 79 401 CA K S 3 FT #HET 299 299 ARG K 85 407 GOL K S 6 FT #HET 305 305 HIS K 87 409 0YR K S 9 FT #HET 309 309 MET K 82 404 CL K S 1 FT #HET 324 324 THR K 80 402 CL K S 2 FT #HET 324 324 THR K 86 408 GOL K B 7 FT #HET 325 325 ILE K 80 402 CL K S 1 FT #HET 325 325 ILE K 86 408 GOL K S 1 FT #HET 327 327 GLU K 87 409 0YR K S 4 FT #HET 329 329 ILE K 82 404 CL K B 2 FT #HET 330 330 PRO K 82 404 CL K B 4 FT #HET 331 331 TRP K 82 404 CL K B 3 FT #HET 332 332 ILE K 82 404 CL K A 4 FT #HET 333 333 LYS K 82 404 CL K A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19L STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 222 222 ASP L 221 221 LYS C Protein S 1 FT #SUB 224 224 ASP L 181 181 ASN C Protein S 1 FT #SUB 225 225 ILE L 215 215 ARG C Protein B 1 FT #SUB 226 226 TYR L 215 215 ARG C Protein A 16 FT #SUB 244 244 ALA L 246 246 ASN C Protein B 1 FT #SUB 247 247 THR L 214 214 GLN C Protein B 1 FT #SUB 247 247 THR L 246 246 ASN C Protein B 3 FT #SUB 248 248 SER L 214 214 GLN C Protein A 5 FT #SUB 248 248 SER L 218 218 ALA C Protein S 2 FT #SUB 248 248 SER L 246 246 ASN C Protein A 2 FT #SUB 250 250 PRO L 211 211 PRO C Protein S 4 FT #SUB 250 250 PRO L 215 215 ARG C Protein S 4 FT #SUB 268 268 ASP L 242 242 ARG C Protein B 1 FT #SUB 270 270 GLY L 242 242 ARG C Protein B 4 FT #SUB 273 273 ALA L 211 211 PRO C Protein S 1 FT #SUB 274 274 TYR L 211 211 PRO C Protein S 6 FT #SUB 274 274 TYR L 212 212 THR C Protein S 1 FT #SUB 274 274 TYR L 215 215 ARG C Protein S 4 FT #SUB 298 298 HIS L 236 236 ASP C Protein B 1 FT #SUB 298 298 HIS L 239 239 SER C Protein B 1 FT #SUB 299 299 ARG L 233 233 TRP C Protein S 3 FT #SUB 299 299 ARG L 236 236 ASP C Protein S 2 FT #SUB 301 301 PRO L 209 209 ASP C Protein S 3 FT #SUB 181 181 ASN L 224 224 ASP H Protein S 2 FT #SUB 209 209 ASP L 301 301 PRO H Protein S 3 FT #SUB 211 211 PRO L 250 250 PRO H Protein A 4 FT #SUB 211 211 PRO L 273 273 ALA H Protein S 1 FT #SUB 211 211 PRO L 274 274 TYR H Protein S 6 FT #SUB 212 212 THR L 274 274 TYR H Protein S 1 FT #SUB 214 214 GLN L 247 247 THR H Protein S 1 FT #SUB 214 214 GLN L 248 248 SER H Protein A 5 FT #SUB 215 215 ARG L 225 225 ILE H Protein S 1 FT #SUB 215 215 ARG L 226 226 TYR H Protein S 15 FT #SUB 215 215 ARG L 250 250 PRO H Protein S 4 FT #SUB 215 215 ARG L 274 274 TYR H Protein S 4 FT #SUB 218 218 ALA L 248 248 SER H Protein S 2 FT #SUB 233 233 TRP L 299 299 ARG H Protein S 3 FT #SUB 236 236 ASP L 298 298 HIS H Protein S 1 FT #SUB 236 236 ASP L 299 299 ARG H Protein S 2 FT #SUB 239 239 SER L 298 298 HIS H Protein S 1 FT #SUB 242 242 ARG L 245 245 ARG H Protein S 1 FT #SUB 242 242 ARG L 268 268 ASP H Protein S 1 FT #SUB 242 242 ARG L 270 270 GLY H Protein S 6 FT #SUB 246 246 ASN L 244 244 ALA H Protein S 1 FT #SUB 246 246 ASN L 247 247 THR H Protein S 2 FT #SUB 246 246 ASN L 248 248 SER H Protein S 2 FT #SUB 24 24 THR L 92 92 PRO I Protein B 2 FT #SUB 25 25 HIS L 92 92 PRO I Protein S 6 FT #SUB 25 25 HIS L 96 96 TRP I Protein S 1 FT #SUB 50 50 GLY L 96 96 TRP I Protein B 4 FT #SUB 51 51 THR L 96 96 TRP I Protein B 2 FT #SUB 52 52 HIS L 96 96 TRP I Protein S 9 FT #SUB 54 54 HIS L 93 93 SER I Protein S 5 FT #SUB 54 54 HIS L 94 94 LEU I Protein S 2 FT #SUB 56 56 PRO L 67 67 ASP I Protein S 2 FT #SUB 56 56 PRO L 68 68 CYS I Protein A 2 FT #SUB 57 57 SER L 68 68 CYS I Protein B 1 FT #SUB 57 57 SER L 94 94 LEU I Protein S 2 FT #SUB 60 60 LEU L 60 60 LEU I Protein A 2 FT #SUB 60 60 LEU L 63 63 SER I Protein S 1 FT #SUB 60 60 LEU L 64 64 CYS I Protein S 2 FT #SUB 63 63 SER L 60 60 LEU I Protein S 1 FT #SUB 64 64 CYS L 60 60 LEU I Protein A 2 FT #SUB 67 67 ASP L 56 56 PRO I Protein A 4 FT #SUB 68 68 CYS L 54 54 HIS I Protein S 1 FT #SUB 68 68 CYS L 56 56 PRO I Protein S 2 FT #SUB 68 68 CYS L 57 57 SER I Protein S 1 FT #SUB 90 90 ARG L 233 233 TRP I Protein S 1 FT #SUB 92 92 PRO L 24 24 THR I Protein S 1 FT #SUB 92 92 PRO L 25 25 HIS I Protein A 5 FT #SUB 93 93 SER L 54 54 HIS I Protein S 4 FT #SUB 94 94 LEU L 54 54 HIS I Protein S 2 FT #SUB 94 94 LEU L 57 57 SER I Protein S 2 FT #SUB 95 95 GLN L 233 233 TRP I Protein S 1 FT #SUB 95 95 GLN L 234 234 TYR I Protein S 2 FT #SUB 96 96 TRP L 25 25 HIS I Protein S 3 FT #SUB 96 96 TRP L 30 30 TRP I Protein S 1 FT #SUB 96 96 TRP L 50 50 GLY I Protein S 4 FT #SUB 96 96 TRP L 51 51 THR I Protein S 2 FT #SUB 96 96 TRP L 52 52 HIS I Protein S 11 FT #SUB 96 96 TRP L 255 255 GLU I Protein S 1 FT #SUB 96 96 TRP L 256 256 GLN I Protein S 3 FT #SUB 96 96 TRP L 281 281 ARG I Protein A 8 FT #SUB 97 97 VAL L 57 57 SER I Protein S 1 FT #SUB 97 97 VAL L 101 101 GLY I Protein B 1 FT #SUB 97 97 VAL L 102 102 ILE I Protein A 4 FT #SUB 97 97 VAL L 105 105 LEU I Protein A 3 FT #SUB 97 97 VAL L 258 258 TYR I Protein B 2 FT #SUB 98 98 GLY L 258 258 TYR I Protein B 6 FT #SUB 99 99 ARG L 233 233 TRP I Protein S 1 FT #SUB 99 99 ARG L 234 234 TYR I Protein S 1 FT #SUB 99 99 ARG L 235 235 ASP I Protein S 9 FT #SUB 99 99 ARG L 256 256 GLN I Protein S 6 FT #SUB 99 99 ARG L 258 258 TYR I Protein S 1 FT #SUB 100 100 ALA L 100 100 ALA I Protein S 1 FT #SUB 100 100 ALA L 101 101 GLY I Protein B 1 FT #SUB 101 101 GLY L 97 97 VAL I Protein B 1 FT #SUB 101 101 GLY L 100 100 ALA I Protein B 1 FT #SUB 102 102 ILE L 97 97 VAL I Protein A 4 FT #SUB 102 102 ILE L 102 102 ILE I Protein S 3 FT #SUB 105 105 LEU L 97 97 VAL I Protein S 3 FT #SUB 233 233 TRP L 90 90 ARG I Protein S 3 FT #SUB 233 233 TRP L 95 95 GLN I Protein S 1 FT #SUB 233 233 TRP L 261 261 ASP I Protein S 6 FT #SUB 234 234 TYR L 95 95 GLN I Protein S 2 FT #SUB 234 234 TYR L 99 99 ARG I Protein S 2 FT #SUB 235 235 ASP L 99 99 ARG I Protein S 10 FT #SUB 235 235 ASP L 261 261 ASP I Protein A 3 FT #SUB 236 236 ASP L 264 264 ARG I Protein S 3 FT #SUB 238 238 THR L 264 264 ARG I Protein S 4 FT #SUB 255 255 GLU L 96 96 TRP I Protein S 2 FT #SUB 256 256 GLN L 96 96 TRP I Protein S 3 FT #SUB 256 256 GLN L 99 99 ARG I Protein A 7 FT #SUB 258 258 TYR L 97 97 VAL I Protein S 2 FT #SUB 258 258 TYR L 98 98 GLY I Protein S 6 FT #SUB 258 258 TYR L 99 99 ARG I Protein S 1 FT #SUB 261 261 ASP L 233 233 TRP I Protein S 6 FT #SUB 261 261 ASP L 235 235 ASP I Protein S 3 FT #SUB 264 264 ARG L 236 236 ASP I Protein S 3 FT #SUB 264 264 ARG L 238 238 THR I Protein S 3 FT #SUB 281 281 ARG L 96 96 TRP I Protein S 8 FT #SUB 77 77 ASP L 128 128 HIS M Protein S 1 FT #SUB 79 79 SER L 128 128 HIS M Protein S 2 FT #SUB 79 79 SER L 131 131 GLY M Protein B 1 FT #SUB 80 80 ASP L 128 128 HIS M Protein S 2 FT #SUB 80 80 ASP L 131 131 GLY M Protein A 5 FT #SUB 80 80 ASP L 132 132 GLY M Protein S 1 FT #SUB 81 81 HIS L 130 130 LEU M Protein S 2 FT #SUB 81 81 HIS L 131 131 GLY M Protein A 3 FT #SUB 82 82 SER L 130 130 LEU M Protein S 1 FT #SUB 82 82 SER L 131 131 GLY M Protein A 7 FT #SUB 82 82 SER L 319 319 TRP M Protein S 3 FT #SUB 83 83 ARG L 131 131 GLY M Protein B 1 FT #SUB 83 83 ARG L 133 133 ALA M Protein S 3 FT #SUB 90 90 ARG L 299 299 ARG M Protein S 1 FT #SUB 118 118 LYS L 128 128 HIS M Protein S 1 FT #SUB 118 118 LYS L 129 129 TYR M Protein S 2 FT #SUB 128 128 HIS L 77 77 ASP M Protein S 1 FT #SUB 128 128 HIS L 79 79 SER M Protein S 2 FT #SUB 128 128 HIS L 80 80 ASP M Protein S 2 FT #SUB 129 129 TYR L 129 129 TYR M Protein S 6 FT #SUB 130 130 LEU L 81 81 HIS M Protein B 2 FT #SUB 130 130 LEU L 82 82 SER M Protein B 1 FT #SUB 131 131 GLY L 79 79 SER M Protein B 1 FT #SUB 131 131 GLY L 80 80 ASP M Protein B 5 FT #SUB 131 131 GLY L 81 81 HIS M Protein B 3 FT #SUB 131 131 GLY L 82 82 SER M Protein B 9 FT #SUB 131 131 GLY L 83 83 ARG M Protein B 1 FT #SUB 132 132 GLY L 80 80 ASP M Protein B 1 FT #SUB 133 133 ALA L 83 83 ARG M Protein B 3 FT #SUB 260 260 VAL L 296 296 LEU M Protein S 1 FT #SUB 260 260 VAL L 297 297 ALA M Protein S 2 FT #SUB 260 260 VAL L 299 299 ARG M Protein S 1 FT #SUB 261 261 ASP L 299 299 ARG M Protein S 10 FT #SUB 264 264 ARG L 297 297 ALA M Protein S 4 FT #SUB 264 264 ARG L 298 298 HIS M Protein S 14 FT #SUB 268 268 ASP L 268 268 ASP M Protein S 1 FT #SUB 268 268 ASP L 298 298 HIS M Protein S 2 FT #SUB 289 289 ILE L 293 293 ASP M Protein B 1 FT #SUB 290 290 GLN L 293 293 ASP M Protein A 3 FT #SUB 290 290 GLN L 296 296 LEU M Protein S 2 FT #SUB 293 293 ASP L 289 289 ILE M Protein S 1 FT #SUB 293 293 ASP L 290 290 GLN M Protein S 4 FT #SUB 293 293 ASP L 293 293 ASP M Protein S 6 FT #SUB 294 294 LEU L 294 294 LEU M Protein S 1 FT #SUB 294 294 LEU L 297 297 ALA M Protein S 1 FT #SUB 296 296 LEU L 260 260 VAL M Protein S 1 FT #SUB 296 296 LEU L 290 290 GLN M Protein S 2 FT #SUB 297 297 ALA L 260 260 VAL M Protein S 1 FT #SUB 297 297 ALA L 264 264 ARG M Protein B 4 FT #SUB 297 297 ALA L 294 294 LEU M Protein S 1 FT #SUB 298 298 HIS L 264 264 ARG M Protein A 12 FT #SUB 298 298 HIS L 268 268 ASP M Protein S 2 FT #SUB 299 299 ARG L 90 90 ARG M Protein S 1 FT #SUB 299 299 ARG L 260 260 VAL M Protein S 1 FT #SUB 299 299 ARG L 261 261 ASP M Protein S 10 FT #SUB 319 319 TRP L 82 82 SER M Protein S 4 FT #HET 22 22 ASP L 94 407 0YR L S 8 FT #HET 25 25 HIS L 94 407 0YR L S 3 FT #HET 30 30 TRP L 94 407 0YR L S 2 FT #HET 52 52 HIS L 94 407 0YR L S 8 FT #HET 96 96 TRP L 78 406 0YR I S 4 FT #HET 97 97 VAL L 90 403 CL L B 1 FT #HET 98 98 GLY L 90 403 CL L B 1 FT #HET 100 100 ALA L 90 403 CL L B 1 FT #HET 101 101 GLY L 74 402 CL I B 2 FT #HET 101 101 GLY L 90 403 CL L B 1 FT #HET 102 102 ILE L 74 402 CL I A 2 FT #HET 102 102 ILE L 90 403 CL L B 2 FT #HET 103 103 THR L 90 403 CL L A 4 FT #HET 147 147 TRP L 94 407 0YR L S 1 FT #HET 172 172 LYS L 91 404 MG L S 1 FT #HET 172 172 LYS L 94 407 0YR L S 3 FT #HET 174 174 LYS L 94 407 0YR L S 7 FT #HET 180 180 PRO L 92 405 GOL L S 5 FT #HET 181 181 ASN L 92 405 GOL L S 5 FT #HET 184 184 ILE L 92 405 GOL L S 1 FT #HET 203 203 ASP L 91 404 MG L S 3 FT #HET 203 203 ASP L 94 407 0YR L S 4 FT #HET 205 205 ASN L 94 407 0YR L S 7 FT #HET 215 215 ARG L 92 405 GOL L A 13 FT #HET 216 216 PHE L 92 405 GOL L B 1 FT #HET 219 219 ALA L 92 405 GOL L S 2 FT #HET 224 224 ASP L 24 405 GOL C S 5 FT #HET 226 226 TYR L 88 401 CL L S 3 FT #HET 229 229 GLU L 91 404 MG L S 4 FT #HET 229 229 GLU L 94 407 0YR L S 2 FT #HET 233 233 TRP L 70 407 GOL H S 6 FT #HET 255 255 GLU L 91 404 MG L S 3 FT #HET 255 255 GLU L 94 407 0YR L S 11 FT #HET 268 268 ASP L 95 401 CA M S 3 FT #HET 274 274 TYR L 88 401 CL L S 1 FT #HET 298 298 HIS L 95 401 CA M S 2 FT #HET 299 299 ARG L 93 406 GOL L S 5 FT #HET 305 305 HIS L 94 407 0YR L S 10 FT #HET 309 309 MET L 89 402 CL L S 1 FT #HET 324 324 THR L 88 401 CL L S 2 FT #HET 327 327 GLU L 94 407 0YR L S 4 FT #HET 329 329 ILE L 89 402 CL L B 2 FT #HET 330 330 PRO L 89 402 CL L B 3 FT #HET 331 331 TRP L 89 402 CL L B 2 FT #HET 332 332 ILE L 89 402 CL L A 4 FT #HET 333 333 LYS L 89 402 CL L A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19M STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 181 181 ASN M 224 224 ASP B Protein S 1 FT #SUB 209 209 ASP M 299 299 ARG B Protein S 1 FT #SUB 209 209 ASP M 301 301 PRO B Protein S 4 FT #SUB 211 211 PRO M 250 250 PRO B Protein A 4 FT #SUB 211 211 PRO M 273 273 ALA B Protein S 1 FT #SUB 211 211 PRO M 274 274 TYR B Protein S 7 FT #SUB 212 212 THR M 274 274 TYR B Protein S 1 FT #SUB 214 214 GLN M 247 247 THR B Protein S 1 FT #SUB 214 214 GLN M 248 248 SER B Protein A 5 FT #SUB 215 215 ARG M 225 225 ILE B Protein S 1 FT #SUB 215 215 ARG M 226 226 TYR B Protein S 14 FT #SUB 215 215 ARG M 250 250 PRO B Protein S 4 FT #SUB 215 215 ARG M 274 274 TYR B Protein S 4 FT #SUB 218 218 ALA M 248 248 SER B Protein S 2 FT #SUB 221 221 LYS M 222 222 ASP B Protein S 1 FT #SUB 233 233 TRP M 299 299 ARG B Protein S 4 FT #SUB 236 236 ASP M 298 298 HIS B Protein S 1 FT #SUB 236 236 ASP M 299 299 ARG B Protein S 2 FT #SUB 239 239 SER M 298 298 HIS B Protein S 1 FT #SUB 242 242 ARG M 245 245 ARG B Protein S 2 FT #SUB 242 242 ARG M 268 268 ASP B Protein S 1 FT #SUB 242 242 ARG M 270 270 GLY B Protein S 6 FT #SUB 246 246 ASN M 244 244 ALA B Protein S 1 FT #SUB 246 246 ASN M 247 247 THR B Protein S 2 FT #SUB 246 246 ASN M 248 248 SER B Protein S 2 FT #SUB 24 24 THR M 92 92 PRO C Protein B 2 FT #SUB 25 25 HIS M 92 92 PRO C Protein S 7 FT #SUB 25 25 HIS M 96 96 TRP C Protein S 1 FT #SUB 50 50 GLY M 96 96 TRP C Protein B 4 FT #SUB 51 51 THR M 96 96 TRP C Protein B 2 FT #SUB 52 52 HIS M 96 96 TRP C Protein S 9 FT #SUB 54 54 HIS M 68 68 CYS C Protein S 1 FT #SUB 54 54 HIS M 93 93 SER C Protein S 5 FT #SUB 54 54 HIS M 94 94 LEU C Protein S 2 FT #SUB 56 56 PRO M 67 67 ASP C Protein S 4 FT #SUB 56 56 PRO M 68 68 CYS C Protein A 2 FT #SUB 57 57 SER M 68 68 CYS C Protein A 2 FT #SUB 57 57 SER M 94 94 LEU C Protein S 2 FT #SUB 60 60 LEU M 60 60 LEU C Protein A 2 FT #SUB 60 60 LEU M 63 63 SER C Protein S 1 FT #SUB 60 60 LEU M 64 64 CYS C Protein S 2 FT #SUB 63 63 SER M 60 60 LEU C Protein S 1 FT #SUB 64 64 CYS M 60 60 LEU C Protein A 2 FT #SUB 67 67 ASP M 56 56 PRO C Protein A 3 FT #SUB 68 68 CYS M 56 56 PRO C Protein S 2 FT #SUB 68 68 CYS M 57 57 SER C Protein S 1 FT #SUB 90 90 ARG M 233 233 TRP C Protein S 2 FT #SUB 92 92 PRO M 24 24 THR C Protein S 2 FT #SUB 92 92 PRO M 25 25 HIS C Protein A 6 FT #SUB 93 93 SER M 54 54 HIS C Protein S 4 FT #SUB 94 94 LEU M 54 54 HIS C Protein S 2 FT #SUB 94 94 LEU M 57 57 SER C Protein S 2 FT #SUB 95 95 GLN M 233 233 TRP C Protein S 2 FT #SUB 95 95 GLN M 234 234 TYR C Protein S 2 FT #SUB 96 96 TRP M 25 25 HIS C Protein S 1 FT #SUB 96 96 TRP M 30 30 TRP C Protein S 1 FT #SUB 96 96 TRP M 50 50 GLY C Protein S 4 FT #SUB 96 96 TRP M 51 51 THR C Protein S 2 FT #SUB 96 96 TRP M 52 52 HIS C Protein S 13 FT #SUB 96 96 TRP M 255 255 GLU C Protein S 1 FT #SUB 96 96 TRP M 256 256 GLN C Protein S 3 FT #SUB 96 96 TRP M 281 281 ARG C Protein A 8 FT #SUB 97 97 VAL M 101 101 GLY C Protein B 1 FT #SUB 97 97 VAL M 102 102 ILE C Protein A 5 FT #SUB 97 97 VAL M 105 105 LEU C Protein A 3 FT #SUB 97 97 VAL M 258 258 TYR C Protein B 3 FT #SUB 98 98 GLY M 258 258 TYR C Protein B 6 FT #SUB 99 99 ARG M 234 234 TYR C Protein S 1 FT #SUB 99 99 ARG M 235 235 ASP C Protein S 10 FT #SUB 99 99 ARG M 256 256 GLN C Protein S 6 FT #SUB 99 99 ARG M 258 258 TYR C Protein S 1 FT #SUB 100 100 ALA M 100 100 ALA C Protein S 1 FT #SUB 100 100 ALA M 101 101 GLY C Protein B 1 FT #SUB 101 101 GLY M 97 97 VAL C Protein B 1 FT #SUB 101 101 GLY M 100 100 ALA C Protein B 1 FT #SUB 102 102 ILE M 97 97 VAL C Protein A 2 FT #SUB 102 102 ILE M 102 102 ILE C Protein S 3 FT #SUB 105 105 LEU M 97 97 VAL C Protein S 3 FT #SUB 233 233 TRP M 90 90 ARG C Protein S 4 FT #SUB 233 233 TRP M 95 95 GLN C Protein S 1 FT #SUB 233 233 TRP M 261 261 ASP C Protein S 5 FT #SUB 234 234 TYR M 95 95 GLN C Protein S 2 FT #SUB 234 234 TYR M 99 99 ARG C Protein S 1 FT #SUB 235 235 ASP M 99 99 ARG C Protein S 9 FT #SUB 235 235 ASP M 261 261 ASP C Protein A 3 FT #SUB 236 236 ASP M 264 264 ARG C Protein S 3 FT #SUB 238 238 THR M 264 264 ARG C Protein S 4 FT #SUB 255 255 GLU M 96 96 TRP C Protein S 1 FT #SUB 256 256 GLN M 96 96 TRP C Protein S 3 FT #SUB 256 256 GLN M 99 99 ARG C Protein A 8 FT #SUB 258 258 TYR M 97 97 VAL C Protein S 3 FT #SUB 258 258 TYR M 98 98 GLY C Protein S 6 FT #SUB 258 258 TYR M 99 99 ARG C Protein S 1 FT #SUB 261 261 ASP M 233 233 TRP C Protein S 6 FT #SUB 261 261 ASP M 235 235 ASP C Protein S 3 FT #SUB 264 264 ARG M 236 236 ASP C Protein S 3 FT #SUB 264 264 ARG M 238 238 THR C Protein S 4 FT #SUB 281 281 ARG M 96 96 TRP C Protein S 8 FT #SUB 222 222 ASP M 221 221 LYS I Protein S 1 FT #SUB 224 224 ASP M 181 181 ASN I Protein S 1 FT #SUB 225 225 ILE M 215 215 ARG I Protein B 2 FT #SUB 226 226 TYR M 215 215 ARG I Protein A 18 FT #SUB 244 244 ALA M 246 246 ASN I Protein B 1 FT #SUB 245 245 ARG M 242 242 ARG I Protein S 2 FT #SUB 247 247 THR M 214 214 GLN I Protein B 1 FT #SUB 247 247 THR M 246 246 ASN I Protein B 3 FT #SUB 248 248 SER M 214 214 GLN I Protein A 5 FT #SUB 248 248 SER M 218 218 ALA I Protein S 2 FT #SUB 248 248 SER M 246 246 ASN I Protein A 2 FT #SUB 250 250 PRO M 211 211 PRO I Protein S 4 FT #SUB 250 250 PRO M 215 215 ARG I Protein S 4 FT #SUB 268 268 ASP M 242 242 ARG I Protein B 1 FT #SUB 270 270 GLY M 242 242 ARG I Protein B 5 FT #SUB 273 273 ALA M 211 211 PRO I Protein S 2 FT #SUB 274 274 TYR M 211 211 PRO I Protein S 6 FT #SUB 274 274 TYR M 215 215 ARG I Protein S 3 FT #SUB 298 298 HIS M 236 236 ASP I Protein B 1 FT #SUB 298 298 HIS M 239 239 SER I Protein B 1 FT #SUB 299 299 ARG M 233 233 TRP I Protein S 3 FT #SUB 299 299 ARG M 236 236 ASP I Protein S 2 FT #SUB 301 301 PRO M 209 209 ASP I Protein S 3 FT #SUB 301 301 PRO M 211 211 PRO I Protein S 1 FT #SUB 77 77 ASP M 128 128 HIS L Protein S 1 FT #SUB 79 79 SER M 128 128 HIS L Protein S 2 FT #SUB 79 79 SER M 131 131 GLY L Protein B 1 FT #SUB 80 80 ASP M 128 128 HIS L Protein S 2 FT #SUB 80 80 ASP M 131 131 GLY L Protein A 5 FT #SUB 80 80 ASP M 132 132 GLY L Protein S 1 FT #SUB 81 81 HIS M 130 130 LEU L Protein S 2 FT #SUB 81 81 HIS M 131 131 GLY L Protein A 3 FT #SUB 82 82 SER M 130 130 LEU L Protein S 1 FT #SUB 82 82 SER M 131 131 GLY L Protein A 9 FT #SUB 82 82 SER M 319 319 TRP L Protein S 4 FT #SUB 83 83 ARG M 131 131 GLY L Protein B 1 FT #SUB 83 83 ARG M 133 133 ALA L Protein S 3 FT #SUB 90 90 ARG M 299 299 ARG L Protein S 1 FT #SUB 128 128 HIS M 77 77 ASP L Protein S 1 FT #SUB 128 128 HIS M 79 79 SER L Protein S 2 FT #SUB 128 128 HIS M 80 80 ASP L Protein S 2 FT #SUB 128 128 HIS M 118 118 LYS L Protein B 1 FT #SUB 129 129 TYR M 118 118 LYS L Protein B 2 FT #SUB 129 129 TYR M 129 129 TYR L Protein S 6 FT #SUB 130 130 LEU M 81 81 HIS L Protein B 2 FT #SUB 130 130 LEU M 82 82 SER L Protein B 1 FT #SUB 131 131 GLY M 79 79 SER L Protein B 1 FT #SUB 131 131 GLY M 80 80 ASP L Protein B 5 FT #SUB 131 131 GLY M 81 81 HIS L Protein B 3 FT #SUB 131 131 GLY M 82 82 SER L Protein B 7 FT #SUB 131 131 GLY M 83 83 ARG L Protein B 1 FT #SUB 132 132 GLY M 80 80 ASP L Protein B 1 FT #SUB 133 133 ALA M 83 83 ARG L Protein B 3 FT #SUB 260 260 VAL M 296 296 LEU L Protein S 1 FT #SUB 260 260 VAL M 297 297 ALA L Protein S 1 FT #SUB 260 260 VAL M 299 299 ARG L Protein S 1 FT #SUB 261 261 ASP M 299 299 ARG L Protein S 10 FT #SUB 264 264 ARG M 297 297 ALA L Protein S 4 FT #SUB 264 264 ARG M 298 298 HIS L Protein S 12 FT #SUB 268 268 ASP M 268 268 ASP L Protein S 1 FT #SUB 268 268 ASP M 298 298 HIS L Protein S 2 FT #SUB 289 289 ILE M 293 293 ASP L Protein B 1 FT #SUB 290 290 GLN M 293 293 ASP L Protein A 4 FT #SUB 290 290 GLN M 296 296 LEU L Protein S 2 FT #SUB 293 293 ASP M 289 289 ILE L Protein S 1 FT #SUB 293 293 ASP M 290 290 GLN L Protein S 3 FT #SUB 293 293 ASP M 293 293 ASP L Protein S 6 FT #SUB 294 294 LEU M 294 294 LEU L Protein S 1 FT #SUB 294 294 LEU M 297 297 ALA L Protein S 1 FT #SUB 296 296 LEU M 260 260 VAL L Protein S 1 FT #SUB 296 296 LEU M 290 290 GLN L Protein S 2 FT #SUB 297 297 ALA M 260 260 VAL L Protein A 2 FT #SUB 297 297 ALA M 264 264 ARG L Protein B 4 FT #SUB 297 297 ALA M 294 294 LEU L Protein S 1 FT #SUB 298 298 HIS M 264 264 ARG L Protein A 14 FT #SUB 298 298 HIS M 268 268 ASP L Protein S 2 FT #SUB 299 299 ARG M 90 90 ARG L Protein S 1 FT #SUB 299 299 ARG M 260 260 VAL L Protein S 1 FT #SUB 299 299 ARG M 261 261 ASP L Protein S 10 FT #SUB 319 319 TRP M 82 82 SER L Protein S 3 FT #HET 22 22 ASP M 101 407 0YR M S 9 FT #HET 25 25 HIS M 101 407 0YR M S 3 FT #HET 30 30 TRP M 101 407 0YR M S 2 FT #HET 52 52 HIS M 101 407 0YR M S 4 FT #HET 90 90 ARG M 93 406 GOL L S 6 FT #HET 96 96 TRP M 27 408 0YR C S 4 FT #HET 101 101 GLY M 22 403 CL C B 2 FT #HET 102 102 ILE M 22 403 CL C A 2 FT #HET 147 147 TRP M 101 407 0YR M S 1 FT #HET 172 172 LYS M 99 405 MG M S 1 FT #HET 172 172 LYS M 101 407 0YR M S 3 FT #HET 174 174 LYS M 101 407 0YR M S 7 FT #HET 180 180 PRO M 100 406 GOL M S 5 FT #HET 181 181 ASN M 100 406 GOL M S 7 FT #HET 184 184 ILE M 100 406 GOL M S 1 FT #HET 203 203 ASP M 99 405 MG M S 3 FT #HET 203 203 ASP M 101 407 0YR M S 4 FT #HET 205 205 ASN M 101 407 0YR M S 7 FT #HET 215 215 ARG M 100 406 GOL M A 14 FT #HET 216 216 PHE M 100 406 GOL M B 1 FT #HET 219 219 ALA M 100 406 GOL M S 2 FT #HET 224 224 ASP M 77 405 GOL I S 5 FT #HET 226 226 TYR M 96 402 CL M S 3 FT #HET 229 229 GLU M 99 405 MG M S 3 FT #HET 229 229 GLU M 101 407 0YR M S 2 FT #HET 233 233 TRP M 25 406 GOL C S 10 FT #HET 255 255 GLU M 99 405 MG M S 3 FT #HET 255 255 GLU M 101 407 0YR M S 10 FT #HET 268 268 ASP M 95 401 CA M S 3 FT #HET 274 274 TYR M 96 402 CL M S 1 FT #HET 298 298 HIS M 95 401 CA M S 3 FT #HET 305 305 HIS M 101 407 0YR M S 9 FT #HET 309 309 MET M 97 403 CL M S 1 FT #HET 324 324 THR M 96 402 CL M S 2 FT #HET 325 325 ILE M 96 402 CL M S 1 FT #HET 327 327 GLU M 101 407 0YR M S 4 FT #HET 329 329 ILE M 97 403 CL M B 2 FT #HET 330 330 PRO M 97 403 CL M B 3 FT #HET 331 331 TRP M 97 403 CL M B 3 FT #HET 332 332 ILE M 97 403 CL M A 4 FT #HET 333 333 LYS M 97 403 CL M A 3 FT #HET 370 370 ALA M 98 404 CL M A 3 FT #HET 371 371 VAL M 98 404 CL M A 2 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19N STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 362 362 GLU N 136 136 ALA G Protein S 4 FT #SUB 364 364 PHE N 343 343 ARG G Protein B 2 FT #SUB 365 365 THR N 346 346 VAL G Protein S 1 FT #SUB 365 365 THR N 347 347 TYR G Protein S 1 FT #SUB 365 365 THR N 348 348 LYS G Protein S 1 FT #SUB 366 366 ARG N 348 348 LYS G Protein B 2 FT #SUB 366 366 ARG N 351 351 GLU G Protein S 9 FT #SUB 368 368 GLY N 343 343 ARG G Protein B 7 FT #SUB 41 41 ASP N 151 151 THR H Protein A 2 FT #SUB 153 153 GLU N 195 195 ASP K Protein S 1 FT #SUB 77 77 ASP N 128 128 HIS P Protein S 1 FT #SUB 79 79 SER N 128 128 HIS P Protein S 1 FT #SUB 79 79 SER N 131 131 GLY P Protein B 1 FT #SUB 80 80 ASP N 128 128 HIS P Protein S 2 FT #SUB 80 80 ASP N 131 131 GLY P Protein A 6 FT #SUB 80 80 ASP N 132 132 GLY P Protein S 1 FT #SUB 81 81 HIS N 130 130 LEU P Protein S 3 FT #SUB 81 81 HIS N 131 131 GLY P Protein A 4 FT #SUB 82 82 SER N 130 130 LEU P Protein S 1 FT #SUB 82 82 SER N 131 131 GLY P Protein A 7 FT #SUB 82 82 SER N 319 319 TRP P Protein S 3 FT #SUB 83 83 ARG N 131 131 GLY P Protein B 1 FT #SUB 83 83 ARG N 133 133 ALA P Protein S 3 FT #SUB 90 90 ARG N 299 299 ARG P Protein S 1 FT #SUB 128 128 HIS N 77 77 ASP P Protein S 1 FT #SUB 128 128 HIS N 79 79 SER P Protein S 1 FT #SUB 128 128 HIS N 80 80 ASP P Protein S 2 FT #SUB 129 129 TYR N 129 129 TYR P Protein S 5 FT #SUB 130 130 LEU N 81 81 HIS P Protein B 2 FT #SUB 130 130 LEU N 82 82 SER P Protein B 1 FT #SUB 131 131 GLY N 79 79 SER P Protein B 1 FT #SUB 131 131 GLY N 80 80 ASP P Protein B 5 FT #SUB 131 131 GLY N 81 81 HIS P Protein B 3 FT #SUB 131 131 GLY N 82 82 SER P Protein B 8 FT #SUB 131 131 GLY N 83 83 ARG P Protein B 1 FT #SUB 132 132 GLY N 80 80 ASP P Protein B 1 FT #SUB 133 133 ALA N 83 83 ARG P Protein B 3 FT #SUB 260 260 VAL N 296 296 LEU P Protein S 1 FT #SUB 260 260 VAL N 297 297 ALA P Protein S 2 FT #SUB 260 260 VAL N 299 299 ARG P Protein S 1 FT #SUB 261 261 ASP N 299 299 ARG P Protein S 10 FT #SUB 264 264 ARG N 297 297 ALA P Protein S 4 FT #SUB 264 264 ARG N 298 298 HIS P Protein S 12 FT #SUB 268 268 ASP N 268 268 ASP P Protein S 1 FT #SUB 268 268 ASP N 298 298 HIS P Protein S 2 FT #SUB 289 289 ILE N 293 293 ASP P Protein B 1 FT #SUB 290 290 GLN N 293 293 ASP P Protein A 4 FT #SUB 290 290 GLN N 296 296 LEU P Protein S 2 FT #SUB 293 293 ASP N 289 289 ILE P Protein S 1 FT #SUB 293 293 ASP N 290 290 GLN P Protein S 4 FT #SUB 293 293 ASP N 293 293 ASP P Protein S 6 FT #SUB 294 294 LEU N 294 294 LEU P Protein S 1 FT #SUB 294 294 LEU N 297 297 ALA P Protein S 1 FT #SUB 296 296 LEU N 260 260 VAL P Protein S 1 FT #SUB 296 296 LEU N 290 290 GLN P Protein S 2 FT #SUB 297 297 ALA N 260 260 VAL P Protein A 2 FT #SUB 297 297 ALA N 264 264 ARG P Protein B 4 FT #SUB 298 298 HIS N 264 264 ARG P Protein A 13 FT #SUB 298 298 HIS N 268 268 ASP P Protein S 5 FT #SUB 299 299 ARG N 90 90 ARG P Protein S 1 FT #SUB 299 299 ARG N 260 260 VAL P Protein S 1 FT #SUB 299 299 ARG N 261 261 ASP P Protein S 10 FT #SUB 319 319 TRP N 82 82 SER P Protein S 4 FT #SUB 24 24 THR N 92 92 PRO J Protein B 2 FT #SUB 25 25 HIS N 92 92 PRO J Protein S 6 FT #SUB 25 25 HIS N 96 96 TRP J Protein S 1 FT #SUB 50 50 GLY N 96 96 TRP J Protein B 4 FT #SUB 51 51 THR N 96 96 TRP J Protein B 2 FT #SUB 52 52 HIS N 96 96 TRP J Protein S 7 FT #SUB 54 54 HIS N 93 93 SER J Protein S 4 FT #SUB 56 56 PRO N 67 67 ASP J Protein S 3 FT #SUB 56 56 PRO N 68 68 CYS J Protein A 2 FT #SUB 57 57 SER N 68 68 CYS J Protein B 1 FT #SUB 57 57 SER N 94 94 LEU J Protein S 2 FT #SUB 57 57 SER N 97 97 VAL J Protein S 1 FT #SUB 60 60 LEU N 60 60 LEU J Protein A 2 FT #SUB 60 60 LEU N 63 63 SER J Protein S 1 FT #SUB 60 60 LEU N 64 64 CYS J Protein S 2 FT #SUB 63 63 SER N 60 60 LEU J Protein S 1 FT #SUB 64 64 CYS N 60 60 LEU J Protein A 2 FT #SUB 67 67 ASP N 56 56 PRO J Protein A 4 FT #SUB 68 68 CYS N 56 56 PRO J Protein S 2 FT #SUB 68 68 CYS N 57 57 SER J Protein S 2 FT #SUB 90 90 ARG N 233 233 TRP J Protein S 3 FT #SUB 92 92 PRO N 24 24 THR J Protein S 2 FT #SUB 92 92 PRO N 25 25 HIS J Protein A 5 FT #SUB 93 93 SER N 54 54 HIS J Protein S 4 FT #SUB 94 94 LEU N 54 54 HIS J Protein S 2 FT #SUB 94 94 LEU N 57 57 SER J Protein S 1 FT #SUB 95 95 GLN N 233 233 TRP J Protein S 2 FT #SUB 95 95 GLN N 234 234 TYR J Protein S 2 FT #SUB 96 96 TRP N 25 25 HIS J Protein S 1 FT #SUB 96 96 TRP N 50 50 GLY J Protein S 4 FT #SUB 96 96 TRP N 51 51 THR J Protein S 2 FT #SUB 96 96 TRP N 52 52 HIS J Protein S 11 FT #SUB 96 96 TRP N 255 255 GLU J Protein S 1 FT #SUB 96 96 TRP N 256 256 GLN J Protein S 3 FT #SUB 96 96 TRP N 258 258 TYR J Protein B 1 FT #SUB 96 96 TRP N 281 281 ARG J Protein A 8 FT #SUB 97 97 VAL N 101 101 GLY J Protein B 1 FT #SUB 97 97 VAL N 102 102 ILE J Protein A 4 FT #SUB 97 97 VAL N 105 105 LEU J Protein A 3 FT #SUB 97 97 VAL N 258 258 TYR J Protein B 3 FT #SUB 98 98 GLY N 258 258 TYR J Protein B 6 FT #SUB 99 99 ARG N 234 234 TYR J Protein S 1 FT #SUB 99 99 ARG N 235 235 ASP J Protein S 9 FT #SUB 99 99 ARG N 256 256 GLN J Protein S 8 FT #SUB 99 99 ARG N 258 258 TYR J Protein S 1 FT #SUB 100 100 ALA N 100 100 ALA J Protein S 1 FT #SUB 100 100 ALA N 101 101 GLY J Protein B 1 FT #SUB 101 101 GLY N 97 97 VAL J Protein B 1 FT #SUB 101 101 GLY N 100 100 ALA J Protein B 1 FT #SUB 102 102 ILE N 97 97 VAL J Protein A 4 FT #SUB 102 102 ILE N 102 102 ILE J Protein S 2 FT #SUB 105 105 LEU N 97 97 VAL J Protein S 2 FT #SUB 233 233 TRP N 90 90 ARG J Protein S 4 FT #SUB 233 233 TRP N 95 95 GLN J Protein S 1 FT #SUB 233 233 TRP N 261 261 ASP J Protein S 6 FT #SUB 234 234 TYR N 95 95 GLN J Protein S 2 FT #SUB 234 234 TYR N 99 99 ARG J Protein S 2 FT #SUB 235 235 ASP N 99 99 ARG J Protein S 10 FT #SUB 235 235 ASP N 261 261 ASP J Protein A 3 FT #SUB 236 236 ASP N 264 264 ARG J Protein S 3 FT #SUB 238 238 THR N 264 264 ARG J Protein S 3 FT #SUB 255 255 GLU N 96 96 TRP J Protein S 2 FT #SUB 256 256 GLN N 96 96 TRP J Protein S 3 FT #SUB 256 256 GLN N 99 99 ARG J Protein A 7 FT #SUB 258 258 TYR N 97 97 VAL J Protein S 2 FT #SUB 258 258 TYR N 98 98 GLY J Protein S 6 FT #SUB 258 258 TYR N 99 99 ARG J Protein S 1 FT #SUB 261 261 ASP N 233 233 TRP J Protein S 6 FT #SUB 261 261 ASP N 235 235 ASP J Protein S 3 FT #SUB 264 264 ARG N 236 236 ASP J Protein S 3 FT #SUB 264 264 ARG N 238 238 THR J Protein S 4 FT #SUB 281 281 ARG N 96 96 TRP J Protein S 8 FT #SUB 224 224 ASP N 181 181 ASN O Protein S 1 FT #SUB 225 225 ILE N 215 215 ARG O Protein B 1 FT #SUB 226 226 TYR N 215 215 ARG O Protein A 15 FT #SUB 244 244 ALA N 246 246 ASN O Protein B 1 FT #SUB 245 245 ARG N 242 242 ARG O Protein S 1 FT #SUB 247 247 THR N 214 214 GLN O Protein B 1 FT #SUB 247 247 THR N 246 246 ASN O Protein B 3 FT #SUB 248 248 SER N 214 214 GLN O Protein A 5 FT #SUB 248 248 SER N 218 218 ALA O Protein S 2 FT #SUB 248 248 SER N 246 246 ASN O Protein A 2 FT #SUB 250 250 PRO N 211 211 PRO O Protein S 4 FT #SUB 250 250 PRO N 215 215 ARG O Protein S 3 FT #SUB 267 267 ILE N 242 242 ARG O Protein B 1 FT #SUB 268 268 ASP N 242 242 ARG O Protein B 1 FT #SUB 270 270 GLY N 242 242 ARG O Protein B 6 FT #SUB 273 273 ALA N 211 211 PRO O Protein S 1 FT #SUB 274 274 TYR N 211 211 PRO O Protein S 7 FT #SUB 274 274 TYR N 215 215 ARG O Protein S 3 FT #SUB 298 298 HIS N 236 236 ASP O Protein B 1 FT #SUB 298 298 HIS N 239 239 SER O Protein B 1 FT #SUB 299 299 ARG N 233 233 TRP O Protein S 3 FT #SUB 299 299 ARG N 236 236 ASP O Protein S 2 FT #SUB 301 301 PRO N 209 209 ASP O Protein S 3 FT #HET 22 22 ASP N 110 409 0YR N S 9 FT #HET 25 25 HIS N 110 409 0YR N S 3 FT #HET 30 30 TRP N 110 409 0YR N S 2 FT #HET 52 52 HIS N 110 409 0YR N S 8 FT #HET 90 90 ARG N 109 408 GOL N S 8 FT #HET 96 96 TRP N 127 408 0YR J S 3 FT #HET 97 97 VAL N 104 403 CL N B 1 FT #HET 98 98 GLY N 104 403 CL N B 1 FT #HET 100 100 ALA N 104 403 CL N B 2 FT #HET 101 101 GLY N 104 403 CL N B 1 FT #HET 101 101 GLY N 122 403 CL J B 2 FT #HET 102 102 ILE N 104 403 CL N B 1 FT #HET 102 102 ILE N 122 403 CL J A 2 FT #HET 103 103 THR N 104 403 CL N A 4 FT #HET 134 134 ARG N 108 407 GOL N S 4 FT #HET 137 137 GLY N 108 407 GOL N B 2 FT #HET 138 138 VAL N 108 407 GOL N B 2 FT #HET 139 139 GLU N 108 407 GOL N A 7 FT #HET 147 147 TRP N 110 409 0YR N S 1 FT #HET 172 172 LYS N 110 409 0YR N S 3 FT #HET 174 174 LYS N 110 409 0YR N S 8 FT #HET 180 180 PRO N 107 406 GOL N S 6 FT #HET 181 181 ASN N 107 406 GOL N A 8 FT #HET 184 184 ILE N 107 406 GOL N S 1 FT #HET 203 203 ASP N 106 405 MG N S 3 FT #HET 203 203 ASP N 110 409 0YR N S 4 FT #HET 205 205 ASN N 110 409 0YR N S 8 FT #HET 215 215 ARG N 107 406 GOL N A 13 FT #HET 216 216 PHE N 107 406 GOL N B 1 FT #HET 219 219 ALA N 107 406 GOL N S 2 FT #HET 224 224 ASP N 133 406 GOL O S 5 FT #HET 226 226 TYR N 103 402 CL N S 3 FT #HET 229 229 GLU N 106 405 MG N S 4 FT #HET 229 229 GLU N 110 409 0YR N S 2 FT #HET 233 233 TRP N 126 407 GOL J S 5 FT #HET 255 255 GLU N 106 405 MG N S 3 FT #HET 255 255 GLU N 110 409 0YR N S 10 FT #HET 268 268 ASP N 102 401 CA N S 3 FT #HET 274 274 TYR N 103 402 CL N S 1 FT #HET 298 298 HIS N 102 401 CA N S 3 FT #HET 299 299 ARG N 116 406 GOL P S 4 FT #HET 305 305 HIS N 110 409 0YR N S 9 FT #HET 309 309 MET N 105 404 CL N S 1 FT #HET 323 323 SER N 108 407 GOL N B 1 FT #HET 324 324 THR N 103 402 CL N S 2 FT #HET 324 324 THR N 108 407 GOL N A 7 FT #HET 325 325 ILE N 108 407 GOL N S 2 FT #HET 327 327 GLU N 110 409 0YR N S 5 FT #HET 329 329 ILE N 105 404 CL N B 2 FT #HET 330 330 PRO N 105 404 CL N B 4 FT #HET 331 331 TRP N 105 404 CL N B 3 FT #HET 332 332 ILE N 105 404 CL N A 4 FT #HET 333 333 LYS N 105 404 CL N A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19P STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 77 77 ASP P 128 128 HIS N Protein S 1 FT #SUB 79 79 SER P 128 128 HIS N Protein S 1 FT #SUB 79 79 SER P 131 131 GLY N Protein B 1 FT #SUB 80 80 ASP P 128 128 HIS N Protein S 2 FT #SUB 80 80 ASP P 131 131 GLY N Protein A 5 FT #SUB 80 80 ASP P 132 132 GLY N Protein S 1 FT #SUB 81 81 HIS P 130 130 LEU N Protein S 2 FT #SUB 81 81 HIS P 131 131 GLY N Protein A 3 FT #SUB 82 82 SER P 130 130 LEU N Protein S 1 FT #SUB 82 82 SER P 131 131 GLY N Protein A 8 FT #SUB 82 82 SER P 319 319 TRP N Protein S 4 FT #SUB 83 83 ARG P 131 131 GLY N Protein B 1 FT #SUB 83 83 ARG P 133 133 ALA N Protein S 3 FT #SUB 90 90 ARG P 299 299 ARG N Protein S 1 FT #SUB 128 128 HIS P 77 77 ASP N Protein S 1 FT #SUB 128 128 HIS P 79 79 SER N Protein S 1 FT #SUB 128 128 HIS P 80 80 ASP N Protein S 2 FT #SUB 129 129 TYR P 129 129 TYR N Protein S 5 FT #SUB 130 130 LEU P 81 81 HIS N Protein B 3 FT #SUB 130 130 LEU P 82 82 SER N Protein B 1 FT #SUB 131 131 GLY P 79 79 SER N Protein B 1 FT #SUB 131 131 GLY P 80 80 ASP N Protein B 6 FT #SUB 131 131 GLY P 81 81 HIS N Protein B 4 FT #SUB 131 131 GLY P 82 82 SER N Protein B 7 FT #SUB 131 131 GLY P 83 83 ARG N Protein B 1 FT #SUB 132 132 GLY P 80 80 ASP N Protein B 1 FT #SUB 133 133 ALA P 83 83 ARG N Protein B 3 FT #SUB 260 260 VAL P 296 296 LEU N Protein S 1 FT #SUB 260 260 VAL P 297 297 ALA N Protein S 2 FT #SUB 260 260 VAL P 299 299 ARG N Protein S 1 FT #SUB 261 261 ASP P 299 299 ARG N Protein S 10 FT #SUB 264 264 ARG P 297 297 ALA N Protein S 4 FT #SUB 264 264 ARG P 298 298 HIS N Protein S 13 FT #SUB 268 268 ASP P 268 268 ASP N Protein S 1 FT #SUB 268 268 ASP P 298 298 HIS N Protein S 5 FT #SUB 289 289 ILE P 293 293 ASP N Protein B 1 FT #SUB 290 290 GLN P 293 293 ASP N Protein A 4 FT #SUB 290 290 GLN P 296 296 LEU N Protein S 2 FT #SUB 293 293 ASP P 289 289 ILE N Protein S 1 FT #SUB 293 293 ASP P 290 290 GLN N Protein S 4 FT #SUB 293 293 ASP P 293 293 ASP N Protein S 6 FT #SUB 294 294 LEU P 294 294 LEU N Protein S 1 FT #SUB 296 296 LEU P 260 260 VAL N Protein S 1 FT #SUB 296 296 LEU P 290 290 GLN N Protein S 2 FT #SUB 297 297 ALA P 260 260 VAL N Protein A 2 FT #SUB 297 297 ALA P 264 264 ARG N Protein B 4 FT #SUB 297 297 ALA P 294 294 LEU N Protein S 1 FT #SUB 298 298 HIS P 264 264 ARG N Protein A 12 FT #SUB 298 298 HIS P 268 268 ASP N Protein S 2 FT #SUB 299 299 ARG P 90 90 ARG N Protein S 1 FT #SUB 299 299 ARG P 260 260 VAL N Protein S 1 FT #SUB 299 299 ARG P 261 261 ASP N Protein S 10 FT #SUB 319 319 TRP P 82 82 SER N Protein S 3 FT #SUB 222 222 ASP P 221 221 LYS J Protein S 1 FT #SUB 224 224 ASP P 181 181 ASN J Protein S 1 FT #SUB 225 225 ILE P 215 215 ARG J Protein B 1 FT #SUB 226 226 TYR P 215 215 ARG J Protein A 15 FT #SUB 244 244 ALA P 246 246 ASN J Protein B 1 FT #SUB 245 245 ARG P 242 242 ARG J Protein S 2 FT #SUB 247 247 THR P 246 246 ASN J Protein B 2 FT #SUB 248 248 SER P 214 214 GLN J Protein A 5 FT #SUB 248 248 SER P 218 218 ALA J Protein S 2 FT #SUB 248 248 SER P 246 246 ASN J Protein A 2 FT #SUB 250 250 PRO P 211 211 PRO J Protein S 4 FT #SUB 250 250 PRO P 215 215 ARG J Protein S 4 FT #SUB 268 268 ASP P 242 242 ARG J Protein B 1 FT #SUB 270 270 GLY P 242 242 ARG J Protein B 5 FT #SUB 273 273 ALA P 211 211 PRO J Protein S 2 FT #SUB 274 274 TYR P 211 211 PRO J Protein S 6 FT #SUB 274 274 TYR P 212 212 THR J Protein S 1 FT #SUB 274 274 TYR P 215 215 ARG J Protein S 4 FT #SUB 298 298 HIS P 236 236 ASP J Protein B 1 FT #SUB 298 298 HIS P 239 239 SER J Protein B 1 FT #SUB 299 299 ARG P 233 233 TRP J Protein S 3 FT #SUB 299 299 ARG P 236 236 ASP J Protein S 2 FT #SUB 301 301 PRO P 209 209 ASP J Protein S 3 FT #SUB 24 24 THR P 92 92 PRO O Protein B 2 FT #SUB 25 25 HIS P 92 92 PRO O Protein S 6 FT #SUB 25 25 HIS P 96 96 TRP O Protein S 1 FT #SUB 30 30 TRP P 96 96 TRP O Protein S 1 FT #SUB 50 50 GLY P 96 96 TRP O Protein B 4 FT #SUB 51 51 THR P 96 96 TRP O Protein B 2 FT #SUB 52 52 HIS P 96 96 TRP O Protein S 11 FT #SUB 54 54 HIS P 68 68 CYS O Protein S 1 FT #SUB 54 54 HIS P 93 93 SER O Protein S 4 FT #SUB 54 54 HIS P 94 94 LEU O Protein S 1 FT #SUB 56 56 PRO P 67 67 ASP O Protein S 4 FT #SUB 56 56 PRO P 68 68 CYS O Protein A 3 FT #SUB 57 57 SER P 68 68 CYS O Protein A 3 FT #SUB 57 57 SER P 94 94 LEU O Protein S 2 FT #SUB 57 57 SER P 97 97 VAL O Protein S 1 FT #SUB 60 60 LEU P 60 60 LEU O Protein A 2 FT #SUB 60 60 LEU P 63 63 SER O Protein S 1 FT #SUB 60 60 LEU P 64 64 CYS O Protein S 1 FT #SUB 63 63 SER P 60 60 LEU O Protein S 1 FT #SUB 64 64 CYS P 60 60 LEU O Protein A 2 FT #SUB 67 67 ASP P 56 56 PRO O Protein A 4 FT #SUB 68 68 CYS P 56 56 PRO O Protein S 3 FT #SUB 68 68 CYS P 57 57 SER O Protein S 1 FT #SUB 90 90 ARG P 233 233 TRP O Protein S 4 FT #SUB 92 92 PRO P 24 24 THR O Protein S 2 FT #SUB 92 92 PRO P 25 25 HIS O Protein A 5 FT #SUB 93 93 SER P 54 54 HIS O Protein S 5 FT #SUB 94 94 LEU P 54 54 HIS O Protein S 2 FT #SUB 94 94 LEU P 57 57 SER O Protein S 2 FT #SUB 95 95 GLN P 233 233 TRP O Protein S 1 FT #SUB 95 95 GLN P 234 234 TYR O Protein S 2 FT #SUB 96 96 TRP P 25 25 HIS O Protein S 2 FT #SUB 96 96 TRP P 50 50 GLY O Protein S 4 FT #SUB 96 96 TRP P 51 51 THR O Protein S 2 FT #SUB 96 96 TRP P 52 52 HIS O Protein S 10 FT #SUB 96 96 TRP P 255 255 GLU O Protein S 2 FT #SUB 96 96 TRP P 256 256 GLN O Protein S 3 FT #SUB 96 96 TRP P 281 281 ARG O Protein A 8 FT #SUB 97 97 VAL P 57 57 SER O Protein S 1 FT #SUB 97 97 VAL P 101 101 GLY O Protein B 1 FT #SUB 97 97 VAL P 102 102 ILE O Protein A 4 FT #SUB 97 97 VAL P 105 105 LEU O Protein A 3 FT #SUB 97 97 VAL P 258 258 TYR O Protein B 2 FT #SUB 98 98 GLY P 258 258 TYR O Protein B 6 FT #SUB 99 99 ARG P 234 234 TYR O Protein S 1 FT #SUB 99 99 ARG P 235 235 ASP O Protein S 9 FT #SUB 99 99 ARG P 256 256 GLN O Protein S 7 FT #SUB 99 99 ARG P 258 258 TYR O Protein S 1 FT #SUB 100 100 ALA P 100 100 ALA O Protein S 1 FT #SUB 100 100 ALA P 101 101 GLY O Protein B 1 FT #SUB 101 101 GLY P 97 97 VAL O Protein B 1 FT #SUB 101 101 GLY P 100 100 ALA O Protein B 1 FT #SUB 102 102 ILE P 97 97 VAL O Protein A 4 FT #SUB 102 102 ILE P 102 102 ILE O Protein S 2 FT #SUB 105 105 LEU P 97 97 VAL O Protein S 3 FT #SUB 233 233 TRP P 90 90 ARG O Protein S 3 FT #SUB 233 233 TRP P 95 95 GLN O Protein S 2 FT #SUB 233 233 TRP P 99 99 ARG O Protein S 1 FT #SUB 233 233 TRP P 261 261 ASP O Protein S 5 FT #SUB 234 234 TYR P 95 95 GLN O Protein S 2 FT #SUB 234 234 TYR P 99 99 ARG O Protein S 2 FT #SUB 235 235 ASP P 99 99 ARG O Protein S 9 FT #SUB 235 235 ASP P 261 261 ASP O Protein A 3 FT #SUB 236 236 ASP P 264 264 ARG O Protein S 3 FT #SUB 238 238 THR P 264 264 ARG O Protein S 4 FT #SUB 255 255 GLU P 96 96 TRP O Protein S 1 FT #SUB 256 256 GLN P 96 96 TRP O Protein S 3 FT #SUB 256 256 GLN P 99 99 ARG O Protein A 7 FT #SUB 258 258 TYR P 97 97 VAL O Protein S 2 FT #SUB 258 258 TYR P 98 98 GLY O Protein S 6 FT #SUB 258 258 TYR P 99 99 ARG O Protein S 1 FT #SUB 261 261 ASP P 233 233 TRP O Protein S 6 FT #SUB 261 261 ASP P 235 235 ASP O Protein S 3 FT #SUB 264 264 ARG P 236 236 ASP O Protein S 4 FT #SUB 264 264 ARG P 238 238 THR O Protein S 5 FT #SUB 281 281 ARG P 96 96 TRP O Protein S 8 FT #HET 20 20 ILE P 119 409 0YR P S 1 FT #HET 22 22 ASP P 119 409 0YR P S 8 FT #HET 25 25 HIS P 119 409 0YR P S 3 FT #HET 30 30 TRP P 119 409 0YR P S 2 FT #HET 52 52 HIS P 119 409 0YR P S 4 FT #HET 67 67 ASP P 118 408 GOL P B 1 FT #HET 68 68 CYS P 118 408 GOL P B 5 FT #HET 71 71 PRO P 118 408 GOL P S 2 FT #HET 90 90 ARG P 116 406 GOL P S 8 FT #HET 91 91 TYR P 118 408 GOL P S 3 FT #HET 96 96 TRP P 135 408 0YR O S 2 FT #HET 97 97 VAL P 112 402 CL P B 2 FT #HET 98 98 GLY P 112 402 CL P B 1 FT #HET 100 100 ALA P 112 402 CL P B 2 FT #HET 101 101 GLY P 112 402 CL P B 1 FT #HET 101 101 GLY P 130 403 CL O B 2 FT #HET 102 102 ILE P 112 402 CL P B 2 FT #HET 102 102 ILE P 130 403 CL O A 2 FT #HET 103 103 THR P 112 402 CL P A 5 FT #HET 134 134 ARG P 117 407 GOL P S 5 FT #HET 135 135 THR P 117 407 GOL P S 5 FT #HET 137 137 GLY P 117 407 GOL P B 5 FT #HET 138 138 VAL P 117 407 GOL P B 2 FT #HET 139 139 GLU P 117 407 GOL P A 7 FT #HET 147 147 TRP P 119 409 0YR P S 1 FT #HET 172 172 LYS P 114 404 MG P S 1 FT #HET 172 172 LYS P 119 409 0YR P S 3 FT #HET 174 174 LYS P 119 409 0YR P S 8 FT #HET 180 180 PRO P 115 405 GOL P S 6 FT #HET 181 181 ASN P 115 405 GOL P A 8 FT #HET 184 184 ILE P 115 405 GOL P S 1 FT #HET 203 203 ASP P 114 404 MG P S 3 FT #HET 203 203 ASP P 119 409 0YR P S 4 FT #HET 205 205 ASN P 119 409 0YR P S 7 FT #HET 215 215 ARG P 115 405 GOL P A 12 FT #HET 216 216 PHE P 115 405 GOL P B 1 FT #HET 219 219 ALA P 115 405 GOL P S 2 FT #HET 224 224 ASP P 124 405 GOL J S 5 FT #HET 226 226 TYR P 111 401 CL P S 3 FT #HET 229 229 GLU P 114 404 MG P S 3 FT #HET 229 229 GLU P 119 409 0YR P S 3 FT #HET 255 255 GLU P 114 404 MG P S 3 FT #HET 255 255 GLU P 119 409 0YR P S 11 FT #HET 268 268 ASP P 102 401 CA N S 3 FT #HET 274 274 TYR P 111 401 CL P S 1 FT #HET 298 298 HIS P 102 401 CA N S 2 FT #HET 299 299 ARG P 109 408 GOL N S 5 FT #HET 305 305 HIS P 119 409 0YR P S 8 FT #HET 309 309 MET P 113 403 CL P S 1 FT #HET 324 324 THR P 111 401 CL P S 2 FT #HET 324 324 THR P 117 407 GOL P B 7 FT #HET 325 325 ILE P 111 401 CL P S 1 FT #HET 327 327 GLU P 119 409 0YR P S 4 FT #HET 329 329 ILE P 113 403 CL P B 2 FT #HET 330 330 PRO P 113 403 CL P B 4 FT #HET 331 331 TRP P 113 403 CL P B 3 FT #HET 332 332 ILE P 113 403 CL P A 4 FT #HET 333 333 LYS P 113 403 CL P A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19J STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 24 24 THR J 92 92 PRO N Protein B 2 FT #SUB 25 25 HIS J 92 92 PRO N Protein S 5 FT #SUB 25 25 HIS J 96 96 TRP N Protein S 1 FT #SUB 50 50 GLY J 96 96 TRP N Protein B 4 FT #SUB 51 51 THR J 96 96 TRP N Protein B 2 FT #SUB 52 52 HIS J 96 96 TRP N Protein S 11 FT #SUB 54 54 HIS J 93 93 SER N Protein S 4 FT #SUB 54 54 HIS J 94 94 LEU N Protein S 2 FT #SUB 56 56 PRO J 67 67 ASP N Protein S 4 FT #SUB 56 56 PRO J 68 68 CYS N Protein A 2 FT #SUB 57 57 SER J 68 68 CYS N Protein B 2 FT #SUB 57 57 SER J 94 94 LEU N Protein S 1 FT #SUB 60 60 LEU J 60 60 LEU N Protein A 2 FT #SUB 60 60 LEU J 63 63 SER N Protein S 1 FT #SUB 60 60 LEU J 64 64 CYS N Protein S 2 FT #SUB 63 63 SER J 60 60 LEU N Protein S 1 FT #SUB 64 64 CYS J 60 60 LEU N Protein A 2 FT #SUB 67 67 ASP J 56 56 PRO N Protein A 3 FT #SUB 68 68 CYS J 56 56 PRO N Protein S 2 FT #SUB 68 68 CYS J 57 57 SER N Protein S 1 FT #SUB 90 90 ARG J 233 233 TRP N Protein S 4 FT #SUB 92 92 PRO J 24 24 THR N Protein S 2 FT #SUB 92 92 PRO J 25 25 HIS N Protein A 6 FT #SUB 93 93 SER J 54 54 HIS N Protein S 4 FT #SUB 94 94 LEU J 57 57 SER N Protein S 2 FT #SUB 95 95 GLN J 233 233 TRP N Protein S 1 FT #SUB 95 95 GLN J 234 234 TYR N Protein S 2 FT #SUB 96 96 TRP J 25 25 HIS N Protein S 1 FT #SUB 96 96 TRP J 50 50 GLY N Protein S 4 FT #SUB 96 96 TRP J 51 51 THR N Protein S 2 FT #SUB 96 96 TRP J 52 52 HIS N Protein S 7 FT #SUB 96 96 TRP J 255 255 GLU N Protein S 2 FT #SUB 96 96 TRP J 256 256 GLN N Protein S 3 FT #SUB 96 96 TRP J 281 281 ARG N Protein A 8 FT #SUB 97 97 VAL J 57 57 SER N Protein S 1 FT #SUB 97 97 VAL J 101 101 GLY N Protein B 1 FT #SUB 97 97 VAL J 102 102 ILE N Protein A 4 FT #SUB 97 97 VAL J 105 105 LEU N Protein S 2 FT #SUB 97 97 VAL J 258 258 TYR N Protein B 2 FT #SUB 98 98 GLY J 258 258 TYR N Protein B 6 FT #SUB 99 99 ARG J 234 234 TYR N Protein S 2 FT #SUB 99 99 ARG J 235 235 ASP N Protein S 10 FT #SUB 99 99 ARG J 256 256 GLN N Protein S 7 FT #SUB 99 99 ARG J 258 258 TYR N Protein S 1 FT #SUB 100 100 ALA J 100 100 ALA N Protein S 1 FT #SUB 100 100 ALA J 101 101 GLY N Protein B 1 FT #SUB 101 101 GLY J 97 97 VAL N Protein B 1 FT #SUB 101 101 GLY J 100 100 ALA N Protein B 1 FT #SUB 102 102 ILE J 97 97 VAL N Protein A 4 FT #SUB 102 102 ILE J 102 102 ILE N Protein S 2 FT #SUB 105 105 LEU J 97 97 VAL N Protein S 3 FT #SUB 233 233 TRP J 90 90 ARG N Protein S 3 FT #SUB 233 233 TRP J 95 95 GLN N Protein S 2 FT #SUB 233 233 TRP J 261 261 ASP N Protein S 6 FT #SUB 234 234 TYR J 95 95 GLN N Protein S 2 FT #SUB 234 234 TYR J 99 99 ARG N Protein S 1 FT #SUB 235 235 ASP J 99 99 ARG N Protein S 9 FT #SUB 235 235 ASP J 261 261 ASP N Protein A 3 FT #SUB 236 236 ASP J 264 264 ARG N Protein S 3 FT #SUB 238 238 THR J 264 264 ARG N Protein S 4 FT #SUB 255 255 GLU J 96 96 TRP N Protein S 1 FT #SUB 256 256 GLN J 96 96 TRP N Protein S 3 FT #SUB 256 256 GLN J 99 99 ARG N Protein A 8 FT #SUB 258 258 TYR J 96 96 TRP N Protein S 1 FT #SUB 258 258 TYR J 97 97 VAL N Protein S 3 FT #SUB 258 258 TYR J 98 98 GLY N Protein S 6 FT #SUB 258 258 TYR J 99 99 ARG N Protein S 1 FT #SUB 261 261 ASP J 233 233 TRP N Protein S 6 FT #SUB 261 261 ASP J 235 235 ASP N Protein S 3 FT #SUB 264 264 ARG J 236 236 ASP N Protein S 3 FT #SUB 264 264 ARG J 238 238 THR N Protein S 3 FT #SUB 281 281 ARG J 96 96 TRP N Protein S 8 FT #SUB 181 181 ASN J 224 224 ASP P Protein S 1 FT #SUB 209 209 ASP J 301 301 PRO P Protein S 3 FT #SUB 211 211 PRO J 250 250 PRO P Protein A 4 FT #SUB 211 211 PRO J 273 273 ALA P Protein S 2 FT #SUB 211 211 PRO J 274 274 TYR P Protein S 6 FT #SUB 212 212 THR J 274 274 TYR P Protein S 1 FT #SUB 214 214 GLN J 248 248 SER P Protein A 5 FT #SUB 215 215 ARG J 225 225 ILE P Protein S 1 FT #SUB 215 215 ARG J 226 226 TYR P Protein S 15 FT #SUB 215 215 ARG J 250 250 PRO P Protein S 4 FT #SUB 215 215 ARG J 274 274 TYR P Protein S 4 FT #SUB 218 218 ALA J 248 248 SER P Protein S 2 FT #SUB 221 221 LYS J 222 222 ASP P Protein S 1 FT #SUB 233 233 TRP J 299 299 ARG P Protein S 3 FT #SUB 236 236 ASP J 298 298 HIS P Protein S 1 FT #SUB 236 236 ASP J 299 299 ARG P Protein S 2 FT #SUB 239 239 SER J 298 298 HIS P Protein S 1 FT #SUB 242 242 ARG J 245 245 ARG P Protein S 2 FT #SUB 242 242 ARG J 268 268 ASP P Protein S 1 FT #SUB 242 242 ARG J 270 270 GLY P Protein S 5 FT #SUB 246 246 ASN J 244 244 ALA P Protein S 1 FT #SUB 246 246 ASN J 247 247 THR P Protein S 2 FT #SUB 246 246 ASN J 248 248 SER P Protein S 2 FT #HET 22 22 ASP J 127 408 0YR J S 9 FT #HET 25 25 HIS J 127 408 0YR J S 3 FT #HET 30 30 TRP J 127 408 0YR J S 2 FT #HET 52 52 HIS J 127 408 0YR J S 7 FT #HET 90 90 ARG J 126 407 GOL J S 7 FT #HET 96 96 TRP J 110 409 0YR N S 2 FT #HET 97 97 VAL J 122 403 CL J B 1 FT #HET 98 98 GLY J 122 403 CL J B 1 FT #HET 100 100 ALA J 122 403 CL J B 2 FT #HET 101 101 GLY J 104 403 CL N B 2 FT #HET 101 101 GLY J 122 403 CL J B 1 FT #HET 102 102 ILE J 104 403 CL N A 2 FT #HET 102 102 ILE J 122 403 CL J B 3 FT #HET 103 103 THR J 122 403 CL J A 5 FT #HET 134 134 ARG J 125 406 GOL J S 4 FT #HET 137 137 GLY J 125 406 GOL J B 2 FT #HET 138 138 VAL J 125 406 GOL J B 2 FT #HET 139 139 GLU J 125 406 GOL J A 7 FT #HET 147 147 TRP J 127 408 0YR J S 1 FT #HET 170 170 ARG J 125 406 GOL J S 1 FT #HET 172 172 LYS J 123 404 MG J S 1 FT #HET 172 172 LYS J 127 408 0YR J S 3 FT #HET 174 174 LYS J 123 404 MG J S 1 FT #HET 174 174 LYS J 127 408 0YR J S 8 FT #HET 180 180 PRO J 124 405 GOL J S 5 FT #HET 181 181 ASN J 124 405 GOL J A 8 FT #HET 184 184 ILE J 124 405 GOL J S 1 FT #HET 203 203 ASP J 123 404 MG J S 3 FT #HET 203 203 ASP J 127 408 0YR J S 5 FT #HET 205 205 ASN J 127 408 0YR J S 8 FT #HET 215 215 ARG J 124 405 GOL J A 12 FT #HET 216 216 PHE J 124 405 GOL J B 1 FT #HET 219 219 ALA J 124 405 GOL J S 2 FT #HET 226 226 TYR J 121 402 CL J S 3 FT #HET 229 229 GLU J 123 404 MG J S 3 FT #HET 229 229 GLU J 127 408 0YR J S 2 FT #HET 233 233 TRP J 109 408 GOL N S 2 FT #HET 255 255 GLU J 123 404 MG J S 3 FT #HET 255 255 GLU J 127 408 0YR J S 10 FT #HET 268 268 ASP J 120 401 CA J S 3 FT #HET 274 274 TYR J 121 402 CL J S 1 FT #HET 298 298 HIS J 120 401 CA J S 3 FT #HET 305 305 HIS J 127 408 0YR J S 9 FT #HET 324 324 THR J 121 402 CL J S 2 FT #HET 324 324 THR J 125 406 GOL J B 7 FT #HET 325 325 ILE J 121 402 CL J S 1 FT #HET 325 325 ILE J 125 406 GOL J S 1 FT #HET 327 327 GLU J 127 408 0YR J S 4 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK // ID 4H19O STANDARD; PRT; 372 AA. DT CONVERTED FROM PDB (SEQRES) 4H19 DE Mandelate racemase OS Agrobacterium tumefaciens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.139 FT #SUB 181 181 ASN O 224 224 ASP N Protein S 1 FT #SUB 209 209 ASP O 301 301 PRO N Protein S 3 FT #SUB 211 211 PRO O 250 250 PRO N Protein A 4 FT #SUB 211 211 PRO O 273 273 ALA N Protein S 1 FT #SUB 211 211 PRO O 274 274 TYR N Protein S 7 FT #SUB 214 214 GLN O 247 247 THR N Protein S 1 FT #SUB 214 214 GLN O 248 248 SER N Protein A 5 FT #SUB 215 215 ARG O 225 225 ILE N Protein S 1 FT #SUB 215 215 ARG O 226 226 TYR N Protein S 15 FT #SUB 215 215 ARG O 250 250 PRO N Protein S 3 FT #SUB 215 215 ARG O 274 274 TYR N Protein S 3 FT #SUB 218 218 ALA O 248 248 SER N Protein S 2 FT #SUB 233 233 TRP O 299 299 ARG N Protein S 3 FT #SUB 236 236 ASP O 298 298 HIS N Protein S 1 FT #SUB 236 236 ASP O 299 299 ARG N Protein S 2 FT #SUB 239 239 SER O 298 298 HIS N Protein S 1 FT #SUB 242 242 ARG O 245 245 ARG N Protein S 1 FT #SUB 242 242 ARG O 267 267 ILE N Protein S 1 FT #SUB 242 242 ARG O 268 268 ASP N Protein S 1 FT #SUB 242 242 ARG O 270 270 GLY N Protein S 6 FT #SUB 246 246 ASN O 244 244 ALA N Protein S 1 FT #SUB 246 246 ASN O 247 247 THR N Protein S 3 FT #SUB 246 246 ASN O 248 248 SER N Protein S 2 FT #SUB 24 24 THR O 92 92 PRO P Protein B 2 FT #SUB 25 25 HIS O 92 92 PRO P Protein S 5 FT #SUB 25 25 HIS O 96 96 TRP P Protein S 2 FT #SUB 50 50 GLY O 96 96 TRP P Protein B 4 FT #SUB 51 51 THR O 96 96 TRP P Protein B 2 FT #SUB 52 52 HIS O 96 96 TRP P Protein S 10 FT #SUB 54 54 HIS O 93 93 SER P Protein S 5 FT #SUB 54 54 HIS O 94 94 LEU P Protein S 2 FT #SUB 56 56 PRO O 67 67 ASP P Protein S 4 FT #SUB 56 56 PRO O 68 68 CYS P Protein A 3 FT #SUB 57 57 SER O 68 68 CYS P Protein B 1 FT #SUB 57 57 SER O 94 94 LEU P Protein S 2 FT #SUB 57 57 SER O 97 97 VAL P Protein S 1 FT #SUB 60 60 LEU O 60 60 LEU P Protein A 2 FT #SUB 60 60 LEU O 63 63 SER P Protein S 1 FT #SUB 60 60 LEU O 64 64 CYS P Protein S 2 FT #SUB 63 63 SER O 60 60 LEU P Protein S 1 FT #SUB 64 64 CYS O 60 60 LEU P Protein B 1 FT #SUB 67 67 ASP O 56 56 PRO P Protein A 4 FT #SUB 68 68 CYS O 54 54 HIS P Protein S 1 FT #SUB 68 68 CYS O 56 56 PRO P Protein S 3 FT #SUB 68 68 CYS O 57 57 SER P Protein S 3 FT #SUB 90 90 ARG O 233 233 TRP P Protein S 3 FT #SUB 92 92 PRO O 24 24 THR P Protein S 2 FT #SUB 92 92 PRO O 25 25 HIS P Protein A 6 FT #SUB 93 93 SER O 54 54 HIS P Protein S 4 FT #SUB 94 94 LEU O 54 54 HIS P Protein S 1 FT #SUB 94 94 LEU O 57 57 SER P Protein S 2 FT #SUB 95 95 GLN O 233 233 TRP P Protein S 2 FT #SUB 95 95 GLN O 234 234 TYR P Protein S 2 FT #SUB 96 96 TRP O 25 25 HIS P Protein S 1 FT #SUB 96 96 TRP O 30 30 TRP P Protein S 1 FT #SUB 96 96 TRP O 50 50 GLY P Protein S 4 FT #SUB 96 96 TRP O 51 51 THR P Protein S 2 FT #SUB 96 96 TRP O 52 52 HIS P Protein S 11 FT #SUB 96 96 TRP O 255 255 GLU P Protein S 1 FT #SUB 96 96 TRP O 256 256 GLN P Protein S 3 FT #SUB 96 96 TRP O 281 281 ARG P Protein A 8 FT #SUB 97 97 VAL O 57 57 SER P Protein S 1 FT #SUB 97 97 VAL O 101 101 GLY P Protein B 1 FT #SUB 97 97 VAL O 102 102 ILE P Protein A 4 FT #SUB 97 97 VAL O 105 105 LEU P Protein A 3 FT #SUB 97 97 VAL O 258 258 TYR P Protein B 2 FT #SUB 98 98 GLY O 258 258 TYR P Protein B 6 FT #SUB 99 99 ARG O 233 233 TRP P Protein S 1 FT #SUB 99 99 ARG O 234 234 TYR P Protein S 2 FT #SUB 99 99 ARG O 235 235 ASP P Protein S 9 FT #SUB 99 99 ARG O 256 256 GLN P Protein S 7 FT #SUB 99 99 ARG O 258 258 TYR P Protein S 1 FT #SUB 100 100 ALA O 100 100 ALA P Protein S 1 FT #SUB 100 100 ALA O 101 101 GLY P Protein B 1 FT #SUB 101 101 GLY O 97 97 VAL P Protein B 1 FT #SUB 101 101 GLY O 100 100 ALA P Protein B 1 FT #SUB 102 102 ILE O 97 97 VAL P Protein A 4 FT #SUB 102 102 ILE O 102 102 ILE P Protein S 2 FT #SUB 105 105 LEU O 97 97 VAL P Protein S 3 FT #SUB 233 233 TRP O 90 90 ARG P Protein S 4 FT #SUB 233 233 TRP O 95 95 GLN P Protein S 1 FT #SUB 233 233 TRP O 261 261 ASP P Protein S 6 FT #SUB 234 234 TYR O 95 95 GLN P Protein S 2 FT #SUB 234 234 TYR O 99 99 ARG P Protein S 1 FT #SUB 235 235 ASP O 99 99 ARG P Protein S 9 FT #SUB 235 235 ASP O 261 261 ASP P Protein A 3 FT #SUB 236 236 ASP O 264 264 ARG P Protein S 4 FT #SUB 238 238 THR O 264 264 ARG P Protein S 5 FT #SUB 255 255 GLU O 96 96 TRP P Protein S 2 FT #SUB 256 256 GLN O 96 96 TRP P Protein S 3 FT #SUB 256 256 GLN O 99 99 ARG P Protein A 7 FT #SUB 258 258 TYR O 97 97 VAL P Protein S 2 FT #SUB 258 258 TYR O 98 98 GLY P Protein S 6 FT #SUB 258 258 TYR O 99 99 ARG P Protein S 1 FT #SUB 261 261 ASP O 233 233 TRP P Protein S 5 FT #SUB 261 261 ASP O 235 235 ASP P Protein S 3 FT #SUB 264 264 ARG O 236 236 ASP P Protein S 3 FT #SUB 264 264 ARG O 238 238 THR P Protein S 4 FT #SUB 281 281 ARG O 96 96 TRP P Protein S 8 FT #HET 22 22 ASP O 135 408 0YR O S 9 FT #HET 25 25 HIS O 135 408 0YR O S 3 FT #HET 30 30 TRP O 135 408 0YR O S 2 FT #HET 52 52 HIS O 135 408 0YR O S 4 FT #HET 54 54 HIS O 118 408 GOL P S 6 FT #HET 96 96 TRP O 119 409 0YR P S 3 FT #HET 97 97 VAL O 130 403 CL O B 1 FT #HET 98 98 GLY O 130 403 CL O B 1 FT #HET 100 100 ALA O 130 403 CL O B 2 FT #HET 101 101 GLY O 112 402 CL P B 2 FT #HET 101 101 GLY O 130 403 CL O B 2 FT #HET 102 102 ILE O 112 402 CL P A 2 FT #HET 102 102 ILE O 130 403 CL O B 2 FT #HET 103 103 THR O 130 403 CL O A 4 FT #HET 147 147 TRP O 135 408 0YR O S 1 FT #HET 172 172 LYS O 132 405 MG O S 1 FT #HET 172 172 LYS O 135 408 0YR O S 3 FT #HET 174 174 LYS O 135 408 0YR O S 7 FT #HET 180 180 PRO O 133 406 GOL O S 5 FT #HET 181 181 ASN O 133 406 GOL O A 8 FT #HET 184 184 ILE O 133 406 GOL O S 1 FT #HET 203 203 ASP O 132 405 MG O S 3 FT #HET 203 203 ASP O 135 408 0YR O S 5 FT #HET 205 205 ASN O 135 408 0YR O S 6 FT #HET 215 215 ARG O 133 406 GOL O A 13 FT #HET 216 216 PHE O 133 406 GOL O B 1 FT #HET 219 219 ALA O 133 406 GOL O S 2 FT #HET 226 226 TYR O 129 402 CL O S 3 FT #HET 229 229 GLU O 132 405 MG O S 3 FT #HET 229 229 GLU O 135 408 0YR O S 2 FT #HET 233 233 TRP O 116 406 GOL P S 2 FT #HET 255 255 GLU O 132 405 MG O S 3 FT #HET 255 255 GLU O 135 408 0YR O S 10 FT #HET 268 268 ASP O 128 401 CA O S 3 FT #HET 274 274 TYR O 129 402 CL O S 1 FT #HET 298 298 HIS O 128 401 CA O S 3 FT #HET 299 299 ARG O 134 407 GOL O S 5 FT #HET 305 305 HIS O 135 408 0YR O S 8 FT #HET 309 309 MET O 131 404 CL O S 1 FT #HET 324 324 THR O 129 402 CL O S 3 FT #HET 327 327 GLU O 135 408 0YR O S 5 FT #HET 329 329 ILE O 131 404 CL O B 2 FT #HET 330 330 PRO O 131 404 CL O B 4 FT #HET 331 331 TRP O 131 404 CL O B 3 FT #HET 332 332 ILE O 131 404 CL O A 4 FT #HET 333 333 LYS O 131 404 CL O A 3 CC SEQUENCE 372 AA (ATOM); CC MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL CC ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK CC KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP CC NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH CC ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL CC PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL CC AESFTRYGKA VK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ATOM MKITAVEPFILHLPLTSESISDSTHSITHWGVVGAKITTSDGIEGYGFTG CC ************************************************** CC SEQRES THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ATOM THAHLPSDRLITSCISDCYAPLLLGEDASDHSRLWTKLARYPSLQWVGRA CC ************************************************** CC SEQRES GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ATOM GITHLALAAVDVALWDIKAKKAGVPLWHYLGGARTAGVEAYNTDIGWLSF CC ************************************************** CC SEQRES TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ATOM TLEDLLAGSARAVEEDGFTRLKIKVGHDDPNIDIARLTAVRERVDSAVRI CC ************************************************** CC SEQRES AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ATOM AIDGNGKWDLPTCQRFCAAAKDLDIYWFEEPLWYDDVTSHARLARNTSIP CC ************************************************** CC SEQRES IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ATOM IALGEQLYTVDAFRSFIDAGAVAYVQPDVTRLGGITEYIQVADLALAHRL CC ************************************************** CC SEQRES PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ATOM PVVPHAGEMSQVHVHLSYWHPASTILEYIPWIKDHFEEPIHVRDGVYKRP CC ************************************************** CC SEQRES EQPGASTTPLAESFTRYGKAVK CC ATOM EQPGASTTPLAESFTRYGKAVK CC ********************** SQ SEQUENCE 372 AA; MW; CN; MKITAVEPFI LHLPLTSESI SDSTHSITHW GVVGAKITTS DGIEGYGFTG THAHLPSDRL ITSCISDCYA PLLLGEDASD HSRLWTKLAR YPSLQWVGRA GITHLALAAV DVALWDIKAK KAGVPLWHYL GGARTAGVEA YNTDIGWLSF TLEDLLAGSA RAVEEDGFTR LKIKVGHDDP NIDIARLTAV RERVDSAVRI AIDGNGKWDL PTCQRFCAAA KDLDIYWFEE PLWYDDVTSH ARLARNTSIP IALGEQLYTV DAFRSFIDAG AVAYVQPDVT RLGGITEYIQ VADLALAHRL PVVPHAGEMS QVHVHLSYWH PASTILEYIP WIKDHFEEPI HVRDGVYKRP EQPGASTTPL AESFTRYGKA VK //