ID 1JLXA STANDARD; PRT; 303 AA. DT CONVERTED FROM PDB (SEQRES) 1JLX DE AGGLUTININ OS Amaranthus caudatus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.200 CC R-Factor 0.196 FT #SUB 6 6 ILE A 65 65 ASN B Protein S 2 FT #SUB 24 24 ASN A 249 249 ASP B Protein A 6 FT #SUB 24 24 ASN A 251 251 HIS B Protein S 5 FT #SUB 24 24 ASN A 287 287 ASN B Protein B 1 FT #SUB 24 24 ASN A 288 288 VAL B Protein A 6 FT #SUB 25 25 ILE A 266 266 PHE B Protein B 3 FT #SUB 25 25 ILE A 287 287 ASN B Protein A 8 FT #SUB 26 26 GLN A 264 264 THR B Protein S 4 FT #SUB 26 26 GLN A 265 265 TRP B Protein S 1 FT #SUB 26 26 GLN A 266 266 PHE B Protein B 1 FT #SUB 26 26 GLN A 286 286 GLN B Protein A 9 FT #SUB 26 26 GLN A 287 287 ASN B Protein A 2 FT #SUB 28 28 TYR A 248 248 SER B Protein S 1 FT #SUB 28 28 TYR A 249 249 ASP B Protein S 15 FT #SUB 39 39 LEU A 63 63 TYR B Protein A 6 FT #SUB 41 41 PRO A 41 41 PRO B Protein S 1 FT #SUB 41 41 PRO A 42 42 LEU B Protein S 1 FT #SUB 41 41 PRO A 63 63 TYR B Protein A 4 FT #SUB 42 42 LEU A 41 41 PRO B Protein S 1 FT #SUB 44 44 GLN A 63 63 TYR B Protein S 1 FT #SUB 62 62 ARG A 62 62 ARG B Protein A 13 FT #SUB 62 62 ARG A 65 65 ASN B Protein S 3 FT #SUB 63 63 TYR A 39 39 LEU B Protein S 6 FT #SUB 63 63 TYR A 41 41 PRO B Protein S 2 FT #SUB 63 63 TYR A 44 44 GLN B Protein S 1 FT #SUB 63 63 TYR A 154 154 TRP B Protein A 5 FT #SUB 64 64 THR A 154 154 TRP B Protein B 1 FT #SUB 65 65 ASN A 6 6 ILE B Protein S 2 FT #SUB 65 65 ASN A 62 62 ARG B Protein S 3 FT #SUB 66 66 LYS A 158 158 PHE B Protein S 3 FT #SUB 69 69 VAL A 207 207 ASN B Protein S 1 FT #SUB 69 69 VAL A 247 247 ARG B Protein S 1 FT #SUB 70 70 ARG A 247 247 ARG B Protein B 1 FT #SUB 71 71 TRP A 247 247 ARG B Protein A 10 FT #SUB 71 71 TRP A 259 259 LEU B Protein S 1 FT #SUB 71 71 TRP A 261 261 MET B Protein A 7 FT #SUB 71 71 TRP A 264 264 THR B Protein S 3 FT #SUB 72 72 SER A 261 261 MET B Protein S 2 FT #SUB 73 73 PRO A 240 240 ASN B Protein S 2 FT #SUB 74 74 ASN A 242 242 ALA B Protein S 1 FT #SUB 74 74 ASN A 262 262 GLN B Protein S 1 FT #SUB 75 75 HIS A 261 261 MET B Protein S 1 FT #SUB 75 75 HIS A 264 264 THR B Protein S 2 FT #SUB 79 79 THR A 247 247 ARG B Protein S 3 FT #SUB 81 81 SER A 207 207 ASN B Protein B 1 FT #SUB 81 81 SER A 208 208 GLY B Protein B 2 FT #SUB 81 81 SER A 247 247 ARG B Protein S 1 FT #SUB 82 82 ALA A 206 206 SER B Protein A 3 FT #SUB 82 82 ALA A 207 207 ASN B Protein B 2 FT #SUB 83 83 ASN A 204 204 VAL B Protein S 1 FT #SUB 83 83 ASN A 205 205 THR B Protein S 1 FT #SUB 83 83 ASN A 206 206 SER B Protein A 5 FT #SUB 84 84 GLU A 206 206 SER B Protein A 5 FT #SUB 92 92 TRP A 207 207 ASN B Protein S 4 FT #SUB 92 92 TRP A 240 240 ASN B Protein S 4 FT #SUB 93 93 ALA A 207 207 ASN B Protein S 1 FT #SUB 129 129 SER A 286 286 GLN B Protein S 2 FT #SUB 154 154 TRP A 63 63 TYR B Protein S 5 FT #SUB 158 158 PHE A 66 66 LYS B Protein S 1 FT #SUB 204 204 VAL A 83 83 ASN B Protein S 1 FT #SUB 205 205 THR A 83 83 ASN B Protein B 2 FT #SUB 206 206 SER A 82 82 ALA B Protein B 3 FT #SUB 206 206 SER A 83 83 ASN B Protein B 5 FT #SUB 206 206 SER A 84 84 GLU B Protein A 4 FT #SUB 207 207 ASN A 69 69 VAL B Protein B 1 FT #SUB 207 207 ASN A 81 81 SER B Protein B 2 FT #SUB 207 207 ASN A 82 82 ALA B Protein B 4 FT #SUB 207 207 ASN A 92 92 TRP B Protein S 5 FT #SUB 207 207 ASN A 93 93 ALA B Protein S 1 FT #SUB 208 208 GLY A 81 81 SER B Protein B 1 FT #SUB 208 208 GLY A 83 83 ASN B Protein B 1 FT #SUB 240 240 ASN A 73 73 PRO B Protein B 1 FT #SUB 240 240 ASN A 92 92 TRP B Protein S 4 FT #SUB 242 242 ALA A 74 74 ASN B Protein S 1 FT #SUB 247 247 ARG A 69 69 VAL B Protein S 1 FT #SUB 247 247 ARG A 70 70 ARG B Protein S 1 FT #SUB 247 247 ARG A 71 71 TRP B Protein S 8 FT #SUB 247 247 ARG A 79 79 THR B Protein S 3 FT #SUB 247 247 ARG A 81 81 SER B Protein S 1 FT #SUB 248 248 SER A 28 28 TYR B Protein B 1 FT #SUB 249 249 ASP A 24 24 ASN B Protein S 6 FT #SUB 249 249 ASP A 28 28 TYR B Protein A 12 FT #SUB 251 251 HIS A 24 24 ASN B Protein S 6 FT #SUB 259 259 LEU A 71 71 TRP B Protein S 1 FT #SUB 261 261 MET A 71 71 TRP B Protein S 6 FT #SUB 261 261 MET A 72 72 SER B Protein A 2 FT #SUB 261 261 MET A 75 75 HIS B Protein B 1 FT #SUB 262 262 GLN A 74 74 ASN B Protein S 1 FT #SUB 264 264 THR A 26 26 GLN B Protein A 7 FT #SUB 264 264 THR A 71 71 TRP B Protein S 5 FT #SUB 264 264 THR A 75 75 HIS B Protein S 2 FT #SUB 266 266 PHE A 25 25 ILE B Protein S 3 FT #SUB 266 266 PHE A 26 26 GLN B Protein S 2 FT #SUB 286 286 GLN A 26 26 GLN B Protein A 9 FT #SUB 286 286 GLN A 129 129 SER B Protein S 1 FT #SUB 287 287 ASN A 24 24 ASN B Protein S 1 FT #SUB 287 287 ASN A 25 25 ILE B Protein S 5 FT #SUB 287 287 ASN A 26 26 GLN B Protein S 4 FT #SUB 288 288 VAL A 24 24 ASN B Protein A 6 FT #HET 1 1 ALA A 5 0 FOR A A 9 FT #HET 2 2 GLY A 5 0 FOR A B 4 FT #HET 3 3 LEU A 5 0 FOR A A 7 FT #HET 57 57 VAL A 5 0 FOR A S 2 FT #HET 74 74 ASN A 1 1 A2G C B 3 FT #HET 74 74 ASN A 2 2 GAL C A 3 FT #HET 75 75 HIS A 1 1 A2G C A 7 FT #HET 75 75 HIS A 2 2 GAL C S 8 FT #HET 76 76 TYR A 1 1 A2G C A 11 FT #HET 77 77 TRP A 1 1 A2G C S 7 FT #HET 124 124 TYR A 6 306 MBN A S 2 FT #HET 126 126 VAL A 1 1 A2G C S 2 FT #HET 130 130 PHE A 1 1 A2G C S 4 FT #HET 135 135 PHE A 1 1 A2G C S 2 FT #HET 135 135 PHE A 6 306 MBN A S 9 FT #HET 261 261 MET A 4 2 GAL D B 1 FT #HET 262 262 GLN A 4 2 GAL D A 7 FT #HET 263 263 LYS A 4 2 GAL D B 1 FT #HET 264 264 THR A 4 2 GAL D S 1 FT DISORDER 300 303 CC SEQUENCE 299 AA (ATOM); CC AGLPVIMCLK SNNHQKYLRY QSDNIQQYGL LQFSADKILD PLAQFEVEPS KTYDGLVHIK CC SRYTNKYLVR WSPNHYWITA SANEPDENKS NWACTLFKPL YVEEGNMKKV RLLHVQLGHY CC TQNYTVGGSF VSYLFAESSQ IDTGSKDVFH VIDWKSIFQF PKGYVTFKGN NGKYLGVITI CC NQLPCLQFGY DNLNDPKVAH QMFVTSNGTI CIKSNYMNKF WRLSTDDWIL VDGNDPRETN CC EAAALFRSDV HDFNVISLLN MQKTWFIKRF TSGKPGFINC MNAATQNVDE TAILEIIEL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AGLPVIMCLKSNNHQKYLRYQSDNIQQYGLLQFSADKILDPLAQFEVEPS CC ATOM AGLPVIMCLKSNNHQKYLRYQSDNIQQYGLLQFSADKILDPLAQFEVEPS CC ************************************************** CC SEQRES KTYDGLVHIKSRYTNKYLVRWSPNHYWITASANEPDENKSNWACTLFKPL CC ATOM KTYDGLVHIKSRYTNKYLVRWSPNHYWITASANEPDENKSNWACTLFKPL CC ************************************************** CC SEQRES YVEEGNMKKVRLLHVQLGHYTQNYTVGGSFVSYLFAESSQIDTGSKDVFH CC ATOM YVEEGNMKKVRLLHVQLGHYTQNYTVGGSFVSYLFAESSQIDTGSKDVFH CC ************************************************** CC SEQRES VIDWKSIFQFPKGYVTFKGNNGKYLGVITINQLPCLQFGYDNLNDPKVAH CC ATOM VIDWKSIFQFPKGYVTFKGNNGKYLGVITINQLPCLQFGYDNLNDPKVAH CC ************************************************** CC SEQRES QMFVTSNGTICIKSNYMNKFWRLSTDDWILVDGNDPRETNEAAALFRSDV CC ATOM QMFVTSNGTICIKSNYMNKFWRLSTDDWILVDGNDPRETNEAAALFRSDV CC ************************************************** CC SEQRES HDFNVISLLNMQKTWFIKRFTSGKPGFINCMNAATQNVDETAILEIIELG CC ATOM HDFNVISLLNMQKTWFIKRFTSGKPGFINCMNAATQNVDETAILEIIEL- CC ************************************************* CC SEQRES QNN CC ATOM --- CC SQ SEQUENCE 303 AA; MW; CN; AGLPVIMCLK SNNHQKYLRY QSDNIQQYGL LQFSADKILD PLAQFEVEPS KTYDGLVHIK SRYTNKYLVR WSPNHYWITA SANEPDENKS NWACTLFKPL YVEEGNMKKV RLLHVQLGHY TQNYTVGGSF VSYLFAESSQ IDTGSKDVFH VIDWKSIFQF PKGYVTFKGN NGKYLGVITI NQLPCLQFGY DNLNDPKVAH QMFVTSNGTI CIKSNYMNKF WRLSTDDWIL VDGNDPRETN EAAALFRSDV HDFNVISLLN MQKTWFIKRF TSGKPGFINC MNAATQNVDE TAILEIIELG QNN // ID 1JLXB STANDARD; PRT; 303 AA. DT CONVERTED FROM PDB (SEQRES) 1JLX DE AGGLUTININ OS Amaranthus caudatus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.200 CC R-Factor 0.196 FT #SUB 6 6 ILE B 65 65 ASN A Protein S 2 FT #SUB 24 24 ASN B 249 249 ASP A Protein A 6 FT #SUB 24 24 ASN B 251 251 HIS A Protein S 6 FT #SUB 24 24 ASN B 287 287 ASN A Protein B 1 FT #SUB 24 24 ASN B 288 288 VAL A Protein A 6 FT #SUB 25 25 ILE B 266 266 PHE A Protein B 3 FT #SUB 25 25 ILE B 287 287 ASN A Protein A 5 FT #SUB 26 26 GLN B 264 264 THR A Protein S 7 FT #SUB 26 26 GLN B 266 266 PHE A Protein B 2 FT #SUB 26 26 GLN B 286 286 GLN A Protein A 9 FT #SUB 26 26 GLN B 287 287 ASN A Protein A 4 FT #SUB 28 28 TYR B 248 248 SER A Protein S 1 FT #SUB 28 28 TYR B 249 249 ASP A Protein S 12 FT #SUB 39 39 LEU B 63 63 TYR A Protein A 6 FT #SUB 41 41 PRO B 41 41 PRO A Protein S 1 FT #SUB 41 41 PRO B 42 42 LEU A Protein S 1 FT #SUB 41 41 PRO B 63 63 TYR A Protein B 2 FT #SUB 42 42 LEU B 41 41 PRO A Protein S 1 FT #SUB 44 44 GLN B 63 63 TYR A Protein S 1 FT #SUB 62 62 ARG B 62 62 ARG A Protein A 13 FT #SUB 62 62 ARG B 65 65 ASN A Protein S 3 FT #SUB 63 63 TYR B 39 39 LEU A Protein S 6 FT #SUB 63 63 TYR B 41 41 PRO A Protein S 4 FT #SUB 63 63 TYR B 44 44 GLN A Protein S 1 FT #SUB 63 63 TYR B 154 154 TRP A Protein A 5 FT #SUB 65 65 ASN B 6 6 ILE A Protein S 2 FT #SUB 65 65 ASN B 62 62 ARG A Protein S 3 FT #SUB 66 66 LYS B 158 158 PHE A Protein S 1 FT #SUB 69 69 VAL B 207 207 ASN A Protein S 1 FT #SUB 69 69 VAL B 247 247 ARG A Protein S 1 FT #SUB 70 70 ARG B 247 247 ARG A Protein B 1 FT #SUB 71 71 TRP B 247 247 ARG A Protein A 8 FT #SUB 71 71 TRP B 259 259 LEU A Protein S 1 FT #SUB 71 71 TRP B 261 261 MET A Protein A 6 FT #SUB 71 71 TRP B 264 264 THR A Protein S 5 FT #SUB 72 72 SER B 261 261 MET A Protein S 2 FT #SUB 73 73 PRO B 240 240 ASN A Protein S 1 FT #SUB 74 74 ASN B 242 242 ALA A Protein S 1 FT #SUB 74 74 ASN B 262 262 GLN A Protein S 1 FT #SUB 75 75 HIS B 261 261 MET A Protein S 1 FT #SUB 75 75 HIS B 264 264 THR A Protein S 2 FT #SUB 79 79 THR B 247 247 ARG A Protein S 3 FT #SUB 81 81 SER B 207 207 ASN A Protein B 2 FT #SUB 81 81 SER B 208 208 GLY A Protein B 1 FT #SUB 81 81 SER B 247 247 ARG A Protein S 1 FT #SUB 82 82 ALA B 206 206 SER A Protein A 3 FT #SUB 82 82 ALA B 207 207 ASN A Protein A 4 FT #SUB 83 83 ASN B 204 204 VAL A Protein S 1 FT #SUB 83 83 ASN B 205 205 THR A Protein S 2 FT #SUB 83 83 ASN B 206 206 SER A Protein A 5 FT #SUB 83 83 ASN B 208 208 GLY A Protein S 1 FT #SUB 84 84 GLU B 206 206 SER A Protein A 4 FT #SUB 92 92 TRP B 207 207 ASN A Protein S 5 FT #SUB 92 92 TRP B 240 240 ASN A Protein S 4 FT #SUB 93 93 ALA B 207 207 ASN A Protein S 1 FT #SUB 129 129 SER B 286 286 GLN A Protein S 1 FT #SUB 154 154 TRP B 63 63 TYR A Protein S 5 FT #SUB 154 154 TRP B 64 64 THR A Protein S 1 FT #SUB 158 158 PHE B 66 66 LYS A Protein S 3 FT #SUB 204 204 VAL B 83 83 ASN A Protein S 1 FT #SUB 205 205 THR B 83 83 ASN A Protein B 1 FT #SUB 206 206 SER B 82 82 ALA A Protein B 3 FT #SUB 206 206 SER B 83 83 ASN A Protein B 5 FT #SUB 206 206 SER B 84 84 GLU A Protein A 5 FT #SUB 207 207 ASN B 69 69 VAL A Protein B 1 FT #SUB 207 207 ASN B 81 81 SER A Protein B 1 FT #SUB 207 207 ASN B 82 82 ALA A Protein B 2 FT #SUB 207 207 ASN B 92 92 TRP A Protein S 4 FT #SUB 207 207 ASN B 93 93 ALA A Protein S 1 FT #SUB 208 208 GLY B 81 81 SER A Protein B 2 FT #SUB 240 240 ASN B 73 73 PRO A Protein B 2 FT #SUB 240 240 ASN B 92 92 TRP A Protein S 4 FT #SUB 242 242 ALA B 74 74 ASN A Protein S 1 FT #SUB 247 247 ARG B 69 69 VAL A Protein S 1 FT #SUB 247 247 ARG B 70 70 ARG A Protein S 1 FT #SUB 247 247 ARG B 71 71 TRP A Protein S 10 FT #SUB 247 247 ARG B 79 79 THR A Protein S 3 FT #SUB 247 247 ARG B 81 81 SER A Protein S 1 FT #SUB 248 248 SER B 28 28 TYR A Protein B 1 FT #SUB 249 249 ASP B 24 24 ASN A Protein S 6 FT #SUB 249 249 ASP B 28 28 TYR A Protein A 15 FT #SUB 251 251 HIS B 24 24 ASN A Protein S 5 FT #SUB 259 259 LEU B 71 71 TRP A Protein S 1 FT #SUB 261 261 MET B 71 71 TRP A Protein S 7 FT #SUB 261 261 MET B 72 72 SER A Protein S 2 FT #SUB 261 261 MET B 75 75 HIS A Protein B 1 FT #SUB 262 262 GLN B 74 74 ASN A Protein S 1 FT #SUB 264 264 THR B 26 26 GLN A Protein A 4 FT #SUB 264 264 THR B 71 71 TRP A Protein S 3 FT #SUB 264 264 THR B 75 75 HIS A Protein S 2 FT #SUB 265 265 TRP B 26 26 GLN A Protein S 1 FT #SUB 266 266 PHE B 25 25 ILE A Protein S 3 FT #SUB 266 266 PHE B 26 26 GLN A Protein S 1 FT #SUB 286 286 GLN B 26 26 GLN A Protein A 9 FT #SUB 286 286 GLN B 129 129 SER A Protein S 2 FT #SUB 287 287 ASN B 24 24 ASN A Protein S 1 FT #SUB 287 287 ASN B 25 25 ILE A Protein S 8 FT #SUB 287 287 ASN B 26 26 GLN A Protein S 2 FT #SUB 288 288 VAL B 24 24 ASN A Protein A 6 FT #HET 1 1 ALA B 7 0 FOR B A 10 FT #HET 2 2 GLY B 7 0 FOR B B 3 FT #HET 3 3 LEU B 7 0 FOR B A 6 FT #HET 57 57 VAL B 7 0 FOR B S 2 FT #HET 74 74 ASN B 3 1 A2G D B 3 FT #HET 74 74 ASN B 4 2 GAL D A 6 FT #HET 75 75 HIS B 3 1 A2G D A 8 FT #HET 75 75 HIS B 4 2 GAL D S 8 FT #HET 76 76 TYR B 3 1 A2G D A 9 FT #HET 77 77 TRP B 3 1 A2G D S 8 FT #HET 124 124 TYR B 8 306 MBN B S 2 FT #HET 126 126 VAL B 3 1 A2G D S 2 FT #HET 130 130 PHE B 3 1 A2G D S 4 FT #HET 135 135 PHE B 3 1 A2G D S 4 FT #HET 135 135 PHE B 8 306 MBN B S 5 FT #HET 262 262 GLN B 2 2 GAL C A 8 FT #HET 263 263 LYS B 2 2 GAL C B 2 FT #HET 264 264 THR B 2 2 GAL C S 1 FT DISORDER 300 303 CC SEQUENCE 299 AA (ATOM); CC AGLPVIMCLK SNNHQKYLRY QSDNIQQYGL LQFSADKILD PLAQFEVEPS KTYDGLVHIK CC SRYTNKYLVR WSPNHYWITA SANEPDENKS NWACTLFKPL YVEEGNMKKV RLLHVQLGHY CC TQNYTVGGSF VSYLFAESSQ IDTGSKDVFH VIDWKSIFQF PKGYVTFKGN NGKYLGVITI CC NQLPCLQFGY DNLNDPKVAH QMFVTSNGTI CIKSNYMNKF WRLSTDDWIL VDGNDPRETN CC EAAALFRSDV HDFNVISLLN MQKTWFIKRF TSGKPGFINC MNAATQNVDE TAILEIIEL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AGLPVIMCLKSNNHQKYLRYQSDNIQQYGLLQFSADKILDPLAQFEVEPS CC ATOM AGLPVIMCLKSNNHQKYLRYQSDNIQQYGLLQFSADKILDPLAQFEVEPS CC ************************************************** CC SEQRES KTYDGLVHIKSRYTNKYLVRWSPNHYWITASANEPDENKSNWACTLFKPL CC ATOM KTYDGLVHIKSRYTNKYLVRWSPNHYWITASANEPDENKSNWACTLFKPL CC ************************************************** CC SEQRES YVEEGNMKKVRLLHVQLGHYTQNYTVGGSFVSYLFAESSQIDTGSKDVFH CC ATOM YVEEGNMKKVRLLHVQLGHYTQNYTVGGSFVSYLFAESSQIDTGSKDVFH CC ************************************************** CC SEQRES VIDWKSIFQFPKGYVTFKGNNGKYLGVITINQLPCLQFGYDNLNDPKVAH CC ATOM VIDWKSIFQFPKGYVTFKGNNGKYLGVITINQLPCLQFGYDNLNDPKVAH CC ************************************************** CC SEQRES QMFVTSNGTICIKSNYMNKFWRLSTDDWILVDGNDPRETNEAAALFRSDV CC ATOM QMFVTSNGTICIKSNYMNKFWRLSTDDWILVDGNDPRETNEAAALFRSDV CC ************************************************** CC SEQRES HDFNVISLLNMQKTWFIKRFTSGKPGFINCMNAATQNVDETAILEIIELG CC ATOM HDFNVISLLNMQKTWFIKRFTSGKPGFINCMNAATQNVDETAILEIIEL- CC ************************************************* CC SEQRES QNN CC ATOM --- CC SQ SEQUENCE 303 AA; MW; CN; AGLPVIMCLK SNNHQKYLRY QSDNIQQYGL LQFSADKILD PLAQFEVEPS KTYDGLVHIK SRYTNKYLVR WSPNHYWITA SANEPDENKS NWACTLFKPL YVEEGNMKKV RLLHVQLGHY TQNYTVGGSF VSYLFAESSQ IDTGSKDVFH VIDWKSIFQF PKGYVTFKGN NGKYLGVITI NQLPCLQFGY DNLNDPKVAH QMFVTSNGTI CIKSNYMNKF WRLSTDDWIL VDGNDPRETN EAAALFRSDV HDFNVISLLN MQKTWFIKRF TSGKPGFINC MNAATQNVDE TAILEIIELG QNN //