ID 6CXGL STANDARD; PRT; 213 AA. DT CONVERTED FROM PDB (SEQRES) 6CXG DE anti-HIV-1 Fab 2G12 light chain OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.199 FT #SUB 32 32 TRP L 107 100C ASN H Protein S 7 FT #SUB 36 36 TYR L 109 100E PRO H Protein S 1 FT #SUB 36 36 TYR L 110 100F PHE H Protein S 6 FT #SUB 36 36 TYR L 113 103 TRP H Protein S 2 FT #SUB 38 38 GLN L 39 39 ARG H Protein S 12 FT #SUB 38 38 GLN L 45 45 LEU H Protein S 1 FT #SUB 38 38 GLN L 95 91 TYR H Protein S 2 FT #SUB 42 42 LYS L 95 91 TYR H Protein B 1 FT #SUB 43 43 ALA L 114 104 GLY H Protein S 1 FT #SUB 44 44 PRO L 113 103 TRP H Protein A 7 FT #SUB 46 46 LEU L 109 100E PRO H Protein S 1 FT #SUB 46 46 LEU L 110 100F PHE H Protein S 2 FT #SUB 46 46 LEU L 111 101 ASP H Protein S 1 FT #SUB 49 49 TYR L 109 100E PRO H Protein S 1 FT #SUB 55 55 LYS L 111 101 ASP H Protein S 1 FT #SUB 85 85 THR L 39 39 ARG H Protein S 3 FT #SUB 87 87 HIS L 43 43 GLY H Protein S 1 FT #SUB 87 87 HIS L 45 45 LEU H Protein S 8 FT #SUB 89 89 GLN L 110 100F PHE H Protein S 4 FT #SUB 91 91 TYR L 107 100C ASN H Protein A 10 FT #SUB 91 91 TYR L 108 100D ASP H Protein S 3 FT #SUB 91 91 TYR L 109 100E PRO H Protein S 2 FT #SUB 92 92 ALA L 99 95 LYS H Protein B 3 FT #SUB 92 92 ALA L 107 100C ASN H Protein B 7 FT #SUB 93 93 GLY L 99 95 LYS H Protein B 2 FT #SUB 93 93 GLY L 106 100B ASP H Protein B 1 FT #SUB 93 93 GLY L 107 100C ASN H Protein B 3 FT #SUB 94 94 TYR L 33 33 THR H Protein S 1 FT #SUB 94 94 TYR L 47 47 TRP H Protein B 2 FT #SUB 94 94 TYR L 50 50 SER H Protein B 4 FT #SUB 94 94 TYR L 52 52 SER H Protein S 4 FT #SUB 94 94 TYR L 57 56 TYR H Protein S 5 FT #SUB 94 94 TYR L 59 58 ASP H Protein B 2 FT #SUB 95 95 SER L 47 47 TRP H Protein A 6 FT #SUB 95 95 SER L 59 58 ASP H Protein S 1 FT #SUB 96 96 ALA L 47 47 TRP H Protein B 8 FT #SUB 98 98 PHE L 45 45 LEU H Protein S 8 FT #SUB 98 98 PHE L 47 47 TRP H Protein S 2 FT #SUB 100 100 GLN L 44 44 GLY H Protein B 2 FT #SUB 126 126 LYS L 183 183 LYS K Protein A 3 FT #SUB 127 127 SER L 127 127 SER K Protein B 1 FT #SUB 127 127 SER L 128 128 GLY K Protein B 2 FT #SUB 128 128 GLY L 127 127 SER K Protein B 3 FT #SUB 183 183 LYS L 126 126 LYS K Protein S 2 FT #SUB 116 116 PHE L 140 130 SER M Protein S 5 FT #SUB 116 116 PHE L 147 139 ALA M Protein S 5 FT #SUB 117 117 ILE L 139 129 LYS M Protein A 6 FT #SUB 118 118 PHE L 134 124 LEU M Protein S 7 FT #SUB 118 118 PHE L 135 125 ALA M Protein S 2 FT #SUB 118 118 PHE L 140 130 SER M Protein S 2 FT #SUB 118 118 PHE L 147 139 ALA M Protein S 3 FT #SUB 121 121 SER L 132 122 PHE M Protein S 3 FT #SUB 121 121 SER L 133 123 PRO M Protein S 2 FT #SUB 123 123 GLU L 132 122 PHE M Protein S 3 FT #SUB 123 123 GLU L 219 221 LYS M Protein S 4 FT #SUB 124 124 GLN L 132 122 PHE M Protein A 9 FT #SUB 124 124 GLN L 153 145 LYS M Protein S 2 FT #SUB 131 131 SER L 151 143 LEU M Protein S 2 FT #SUB 131 131 SER L 153 145 LYS M Protein S 1 FT #SUB 135 135 LEU L 176 174 PHE M Protein S 2 FT #SUB 135 135 LEU L 191 190 VAL M Protein S 2 FT #SUB 137 137 ASN L 174 172 HIS M Protein S 3 FT #SUB 137 137 ASN L 193 192 THR M Protein S 1 FT #SUB 138 138 ASN L 174 172 HIS M Protein S 4 FT #SUB 160 160 GLN L 179 177 VAL M Protein S 1 FT #SUB 160 160 GLN L 180 178 LEU M Protein S 1 FT #SUB 160 160 GLN L 181 179 GLN M Protein S 1 FT #SUB 161 161 GLU L 179 177 VAL M Protein B 1 FT #SUB 162 162 SER L 176 174 PHE M Protein A 4 FT #SUB 162 162 SER L 177 175 PRO M Protein S 8 FT #SUB 163 163 VAL L 177 175 PRO M Protein B 3 FT #SUB 164 164 THR L 176 174 PHE M Protein S 2 FT #SUB 167 167 ASP L 174 172 HIS M Protein S 1 FT #SUB 174 174 SER L 174 172 HIS M Protein S 5 FT #SUB 174 174 SER L 176 174 PHE M Protein B 2 FT #SUB 175 175 LEU L 176 174 PHE M Protein B 7 FT #SUB 176 176 SER L 176 174 PHE M Protein A 9 FT #SUB 208 208 SER L 139 129 LYS M Protein B 2 FT #SUB 209 209 PHE L 139 129 LYS M Protein S 2 FT #SUB 94 94 TYR L 30 30 TRP A Protein S 3 FT #SUB 94 94 TYR L 32 32 PRO A Protein S 1 FT #HET 93 93 GLY L 9 9 MAN B B 4 FT #HET 94 94 TYR L 1 1 BMA B S 1 FT #HET 94 94 TYR L 5 5 MAN B S 2 FT #HET 94 94 TYR L 9 9 MAN B S 1 FT #HET 160 160 GLN L 17 301 GOL L B 2 FT #HET 162 162 SER L 17 301 GOL L S 4 FT #HET 176 176 SER L 17 301 GOL L A 8 FT #HET 177 177 SER L 17 301 GOL L B 3 FT #HET 178 178 THR L 17 301 GOL L A 5 FT #HET 197 197 THR L 18 302 GOL L A 3 FT #HET 198 198 HIS L 18 302 GOL L B 6 FT #HET 201 201 LEU L 18 302 GOL L A 9 FT #HET 202 202 SER L 18 302 GOL L B 2 FT #HET 203 203 SER L 18 302 GOL L B 6 FT #HET 204 204 PRO L 18 302 GOL L B 3 CC SEQUENCE 213 AA (ATOM); CC AVVMTQSPST LSASVGDTIT ITCRASQSIE TWLAWYQQKP GKAPKLLIYK ASTLKTGVPS CC RFSGSGSGTE FTLTISGLQF DDFATYHCQH YAGYSATFGQ GTRVEIKRTV AAPSVFIFPP CC SDEQLKSGTA SVVCLLNNFY PREAKVQWKV DNALQSGNSQ ESVTEQDSKD STYSLSSTLT CC LSKADYEKHK VYACEVTHQG LSSPVTKSFN RGE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AVVMTQSPSTLSASVGDTITITCRASQSIETWLAWYQQKPGKAPKLLIYK CC ATOM AVVMTQSPSTLSASVGDTITITCRASQSIETWLAWYQQKPGKAPKLLIYK CC ************************************************** CC SEQRES ASTLKTGVPSRFSGSGSGTEFTLTISGLQFDDFATYHCQHYAGYSATFGQ CC ATOM ASTLKTGVPSRFSGSGSGTEFTLTISGLQFDDFATYHCQHYAGYSATFGQ CC ************************************************** CC SEQRES GTRVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKV CC ATOM GTRVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKV CC ************************************************** CC SEQRES DNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQG CC ATOM DNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQG CC ************************************************** CC SEQRES LSSPVTKSFNRGE CC ATOM LSSPVTKSFNRGE CC ************* SQ SEQUENCE 213 AA; MW; CN; AVVMTQSPST LSASVGDTIT ITCRASQSIE TWLAWYQQKP GKAPKLLIYK ASTLKTGVPS RFSGSGSGTE FTLTISGLQF DDFATYHCQH YAGYSATFGQ GTRVEIKRTV AAPSVFIFPP SDEQLKSGTA SVVCLLNNFY PREAKVQWKV DNALQSGNSQ ESVTEQDSKD STYSLSSTLT LSKADYEKHK VYACEVTHQG LSSPVTKSFN RGE // ID 6CXGH STANDARD; PRT; 224 AA. DT CONVERTED FROM PDB (SEQRES) 6CXG DE anti-HIV-1 Fab 2g12 heavy chain OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.199 FT #SUB 33 33 THR H 94 94 TYR L Protein S 1 FT #SUB 39 39 ARG H 38 38 GLN L Protein S 12 FT #SUB 39 39 ARG H 85 85 THR L Protein S 3 FT #SUB 43 43 GLY H 87 87 HIS L Protein B 1 FT #SUB 44 44 GLY H 100 100 GLN L Protein B 2 FT #SUB 45 45 LEU H 38 38 GLN L Protein S 1 FT #SUB 45 45 LEU H 87 87 HIS L Protein S 8 FT #SUB 45 45 LEU H 98 98 PHE L Protein A 8 FT #SUB 47 47 TRP H 94 94 TYR L Protein S 2 FT #SUB 47 47 TRP H 95 95 SER L Protein S 6 FT #SUB 47 47 TRP H 96 96 ALA L Protein S 8 FT #SUB 47 47 TRP H 98 98 PHE L Protein B 2 FT #SUB 50 50 SER H 94 94 TYR L Protein S 4 FT #SUB 52 52 SER H 94 94 TYR L Protein A 4 FT #SUB 57 56 TYR H 94 94 TYR L Protein S 5 FT #SUB 59 58 ASP H 94 94 TYR L Protein S 2 FT #SUB 59 58 ASP H 95 95 SER L Protein S 1 FT #SUB 95 91 TYR H 38 38 GLN L Protein S 2 FT #SUB 95 91 TYR H 42 42 LYS L Protein S 1 FT #SUB 99 95 LYS H 92 92 ALA L Protein S 3 FT #SUB 99 95 LYS H 93 93 GLY L Protein S 2 FT #SUB 106 100B ASP H 93 93 GLY L Protein B 1 FT #SUB 107 100C ASN H 32 32 TRP L Protein A 7 FT #SUB 107 100C ASN H 91 91 TYR L Protein A 10 FT #SUB 107 100C ASN H 92 92 ALA L Protein S 7 FT #SUB 107 100C ASN H 93 93 GLY L Protein S 3 FT #SUB 108 100D ASP H 91 91 TYR L Protein B 3 FT #SUB 109 100E PRO H 36 36 TYR L Protein S 1 FT #SUB 109 100E PRO H 46 46 LEU L Protein S 1 FT #SUB 109 100E PRO H 49 49 TYR L Protein S 1 FT #SUB 109 100E PRO H 91 91 TYR L Protein B 2 FT #SUB 110 100F PHE H 36 36 TYR L Protein A 6 FT #SUB 110 100F PHE H 46 46 LEU L Protein B 2 FT #SUB 110 100F PHE H 89 89 GLN L Protein S 4 FT #SUB 111 101 ASP H 46 46 LEU L Protein B 1 FT #SUB 111 101 ASP H 55 55 LYS L Protein B 1 FT #SUB 113 103 TRP H 36 36 TYR L Protein S 2 FT #SUB 113 103 TRP H 44 44 PRO L Protein S 7 FT #SUB 114 104 GLY H 43 43 ALA L Protein B 1 FT #SUB 132 122 PHE H 121 121 SER K Protein S 3 FT #SUB 132 122 PHE H 123 123 GLU K Protein S 6 FT #SUB 132 122 PHE H 124 124 GLN K Protein S 11 FT #SUB 133 123 PRO H 121 121 SER K Protein A 3 FT #SUB 134 124 LEU H 118 118 PHE K Protein A 7 FT #SUB 134 124 LEU H 133 133 VAL K Protein S 1 FT #SUB 135 125 ALA H 118 118 PHE K Protein B 2 FT #SUB 147 139 ALA H 116 116 PHE K Protein S 6 FT #SUB 147 139 ALA H 118 118 PHE K Protein B 3 FT #SUB 151 143 LEU H 131 131 SER K Protein S 1 FT #SUB 153 145 LYS H 124 124 GLN K Protein S 2 FT #SUB 153 145 LYS H 131 131 SER K Protein S 2 FT #SUB 174 172 HIS H 137 137 ASN K Protein S 2 FT #SUB 174 172 HIS H 138 138 ASN K Protein S 4 FT #SUB 174 172 HIS H 167 167 ASP K Protein S 1 FT #SUB 174 172 HIS H 174 174 SER K Protein S 3 FT #SUB 175 173 THR H 164 164 THR K Protein B 1 FT #SUB 176 174 PHE H 135 135 LEU K Protein S 2 FT #SUB 176 174 PHE H 162 162 SER K Protein S 2 FT #SUB 176 174 PHE H 164 164 THR K Protein S 2 FT #SUB 176 174 PHE H 174 174 SER K Protein S 4 FT #SUB 176 174 PHE H 175 175 LEU K Protein S 4 FT #SUB 176 174 PHE H 176 176 SER K Protein S 8 FT #SUB 177 175 PRO H 162 162 SER K Protein A 6 FT #SUB 177 175 PRO H 163 163 VAL K Protein S 3 FT #SUB 179 177 VAL H 160 160 GLN K Protein S 1 FT #SUB 179 177 VAL H 161 161 GLU K Protein S 1 FT #SUB 180 178 LEU H 160 160 GLN K Protein B 4 FT #SUB 181 179 GLN H 160 160 GLN K Protein A 2 FT #SUB 189 188 SER H 176 176 SER K Protein S 2 FT #SUB 191 190 VAL H 135 135 LEU K Protein S 1 FT #SUB 193 192 THR H 137 137 ASN K Protein S 2 FT #SUB 219 221 LYS H 123 123 GLU K Protein S 4 FT #SUB 7 7 SER H 19 19 ILE M Protein B 1 FT #SUB 7 7 SER H 84 82A HIS M Protein S 2 FT #SUB 11 11 LEU H 181 179 GLN M Protein S 1 FT #SUB 11 11 LEU H 182 180 SER M Protein S 3 FT #SUB 11 11 LEU H 184 183 GLY M Protein S 2 FT #SUB 19 19 ILE H 19 19 ILE M Protein A 6 FT #SUB 19 19 ILE H 21 21 SER M Protein S 3 FT #SUB 19 19 ILE H 80 79 TYR M Protein S 1 FT #SUB 20 20 LEU H 19 19 ILE M Protein B 2 FT #SUB 21 21 SER H 19 19 ILE M Protein A 4 FT #SUB 21 21 SER H 82 81 GLN M Protein S 3 FT #SUB 54 53 SER H 75 74 LEU M Protein B 1 FT #SUB 55 54 SER H 75 74 LEU M Protein A 3 FT #SUB 58 57 ARG H 73 72 ASP M Protein S 8 FT #SUB 58 57 ARG H 75 74 LEU M Protein S 1 FT #SUB 58 57 ARG H 76 75 GLU M Protein S 13 FT #SUB 69 68 THR H 76 75 GLU M Protein S 4 FT #SUB 69 68 THR H 78 77 PHE M Protein S 2 FT #SUB 71 70 SER H 73 72 ASP M Protein S 4 FT #SUB 71 70 SER H 80 79 TYR M Protein S 6 FT #SUB 73 72 ASP H 58 57 ARG M Protein S 8 FT #SUB 73 72 ASP H 71 70 SER M Protein S 4 FT #SUB 75 74 LEU H 55 54 SER M Protein S 2 FT #SUB 75 74 LEU H 58 57 ARG M Protein S 1 FT #SUB 76 75 GLU H 58 57 ARG M Protein S 12 FT #SUB 76 75 GLU H 69 68 THR M Protein S 1 FT #SUB 78 77 PHE H 69 68 THR M Protein S 1 FT #SUB 78 77 PHE H 82 81 GLN M Protein S 7 FT #SUB 80 79 TYR H 71 70 SER M Protein S 6 FT #SUB 80 79 TYR H 80 79 TYR M Protein S 11 FT #SUB 80 79 TYR H 82 81 GLN M Protein S 6 FT #SUB 82 81 GLN H 21 21 SER M Protein S 3 FT #SUB 82 81 GLN H 78 77 PHE M Protein S 7 FT #SUB 82 81 GLN H 80 79 TYR M Protein S 6 FT #SUB 84 82A HIS H 7 7 SER M Protein S 2 FT #SUB 120 110 THR H 180 178 LEU M Protein S 1 FT #SUB 181 179 GLN H 11 11 LEU M Protein B 1 FT #SUB 182 180 SER H 11 11 LEU M Protein B 1 FT #SUB 184 183 GLY H 11 11 LEU M Protein B 2 FT #SUB 56 55 THR H 20 20 FOD A Protein A 6 FT #SUB 56 55 THR H 28 28 TYR A Protein B 2 FT #SUB 57 56 TYR H 26 26 TYR A Protein S 3 FT #SUB 57 56 TYR H 30 30 TRP A Protein S 7 FT #SUB 57 56 TYR H 32 32 PRO A Protein S 2 FT #SUB 58 57 ARG H 22 22 SER A Protein S 1 FT #SUB 58 57 ARG H 26 26 TYR A Protein B 5 FT #SUB 58 57 ARG H 28 28 TYR A Protein A 11 FT #SUB 59 58 ASP H 26 26 TYR A Protein A 3 FT #SUB 60 59 TYR H 22 22 SER A Protein S 6 FT #SUB 60 59 TYR H 26 26 TYR A Protein S 4 FT #SUB 65 64 LYS H 26 26 TYR A Protein S 8 FT #SUB 66 65 GLY H 22 22 SER A Protein B 2 FT #SUB 66 65 GLY H 23 23 ILE A Protein B 4 FT #SUB 66 65 GLY H 24 24 PRO A Protein B 5 FT #SUB 67 66 ARG H 23 23 ILE A Protein B 2 FT #SUB 68 67 PHE H 22 22 SER A Protein B 1 FT #SUB 68 67 PHE H 23 23 ILE A Protein B 3 FT #SUB 69 68 THR H 22 22 SER A Protein S 3 FT #SUB 82 81 GLN H 23 23 ILE A Protein S 1 FT #SUB 84 82A HIS H 23 23 ILE A Protein S 2 FT #SUB 28 28 ARG H 19 19 ILE C Protein S 5 FT #SUB 28 28 ARG H 21 21 ARG C Protein S 4 FT #SUB 75 74 LEU H 19 19 ILE C Protein B 1 FT #SUB 76 75 GLU H 20 20 FOD C Protein S 2 FT #SUB 76 75 GLU H 21 21 ARG C Protein A 5 FT #SUB 76 75 GLU H 22 22 SER C Protein S 10 FT #SUB 76 75 GLU H 28 28 TYR C Protein S 5 FT #SUB 77 76 ASP H 21 21 ARG C Protein S 3 FT #SUB 78 77 PHE H 23 23 ILE C Protein S 2 FT #HET 31 31 ALA H 8 8 MAN B A 7 FT #HET 31 31 ALA H 9 9 MAN B B 2 FT #HET 32 32 HIS H 9 9 MAN B A 4 FT #HET 33 33 THR H 9 9 MAN B A 16 FT #HET 53 52A THR H 5 5 MAN B A 12 FT #HET 53 52A THR H 8 8 MAN B S 1 FT #HET 54 53 SER H 5 5 MAN B S 2 FT #HET 54 53 SER H 6 6 MAN B S 1 FT #HET 56 55 THR H 1 1 BMA B S 2 FT #HET 56 55 THR H 5 5 MAN B S 1 FT #HET 99 95 LYS H 9 9 MAN B A 12 FT #HET 100 96 GLY H 9 9 MAN B B 2 FT #HET 104 100 LEU H 8 8 MAN B S 1 FT #HET 104 100 LEU H 9 9 MAN B S 1 FT #HET 105 100A SER H 8 8 MAN B B 1 FT #HET 105 100A SER H 9 9 MAN B B 6 FT #HET 106 100B ASP H 8 8 MAN B A 3 FT #HET 106 100B ASP H 9 9 MAN B B 4 FT #HET 107 100C ASN H 9 9 MAN B B 3 FT #HET 108 100D ASP H 9 9 MAN B A 8 FT #HET 176 174 PHE H 19 301 GOL K A 3 FT #HET 177 175 PRO H 19 301 GOL K B 3 FT #HET 179 177 VAL H 19 301 GOL K S 1 FT #HET 187 186 SER H 19 301 GOL K A 3 FT #HET 188 187 LEU H 19 301 GOL K A 6 FT #HET 189 188 SER H 19 301 GOL K A 3 FT DISORDER 138 142 CC SEQUENCE 219 AA (ATOM); CC EVQLVESGGG LVKAGGSLIL SCGVSNFRIS AHTMNWVRRV PGGGLEWVAS ISTSSTYRDY CC ADAVKGRFTV SRDDLEDFVY LQMHKMRVED TAIYYCARKG SDRLSDNDPF DAWGPGTVVT CC VSPASTKGPS VFPLAPSGGT AALGCLVKDY FPEPVTVSWN SGALTSGVHT FPAVLQSSGL CC YSLSSVVTVP SSSLGTQTYI CNVNHKPSNT KVDKKVEPK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES EVQLVESGGGLVKAGGSLILSCGVSNFRISAHTMNWVRRVPGGGLEWVAS CC ATOM EVQLVESGGGLVKAGGSLILSCGVSNFRISAHTMNWVRRVPGGGLEWVAS CC ************************************************** CC SEQRES ISTSSTYRDYADAVKGRFTVSRDDLEDFVYLQMHKMRVEDTAIYYCARKG CC ATOM ISTSSTYRDYADAVKGRFTVSRDDLEDFVYLQMHKMRVEDTAIYYCARKG CC ************************************************** CC SEQRES SDRLSDNDPFDAWGPGTVVTVSPASTKGPSVFPLAPSSKSTSGGTAALGC CC ATOM SDRLSDNDPFDAWGPGTVVTVSPASTKGPSVFPLAPS-----GGTAALGC CC ************************************* ******** CC SEQRES LVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLG CC ATOM LVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLG CC ************************************************** CC SEQRES TQTYICNVNHKPSNTKVDKKVEPK CC ATOM TQTYICNVNHKPSNTKVDKKVEPK CC ************************ SQ SEQUENCE 224 AA; MW; CN; EVQLVESGGG LVKAGGSLIL SCGVSNFRIS AHTMNWVRRV PGGGLEWVAS ISTSSTYRDY ADAVKGRFTV SRDDLEDFVY LQMHKMRVED TAIYYCARKG SDRLSDNDPF DAWGPGTVVT VSPASTKGPS VFPLAPSSKS TSGGTAALGC LVKDYFPEPV TVSWNSGALT SGVHTFPAVL QSSGLYSLSS VVTVPSSSLG TQTYICNVNH KPSNTKVDKK VEPK // ID 6CXGK STANDARD; PRT; 213 AA. DT CONVERTED FROM PDB (SEQRES) 6CXG DE anti-HIV-1 Fab 2G12 light chain OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.199 FT #SUB 126 126 LYS K 183 183 LYS L Protein A 2 FT #SUB 127 127 SER K 127 127 SER L Protein B 1 FT #SUB 127 127 SER K 128 128 GLY L Protein B 3 FT #SUB 128 128 GLY K 127 127 SER L Protein B 2 FT #SUB 183 183 LYS K 126 126 LYS L Protein S 3 FT #SUB 116 116 PHE K 147 139 ALA H Protein S 6 FT #SUB 118 118 PHE K 134 124 LEU H Protein S 7 FT #SUB 118 118 PHE K 135 125 ALA H Protein S 2 FT #SUB 118 118 PHE K 147 139 ALA H Protein S 3 FT #SUB 121 121 SER K 132 122 PHE H Protein S 3 FT #SUB 121 121 SER K 133 123 PRO H Protein S 3 FT #SUB 123 123 GLU K 132 122 PHE H Protein S 6 FT #SUB 123 123 GLU K 219 221 LYS H Protein S 4 FT #SUB 124 124 GLN K 132 122 PHE H Protein A 11 FT #SUB 124 124 GLN K 153 145 LYS H Protein S 2 FT #SUB 131 131 SER K 151 143 LEU H Protein S 1 FT #SUB 131 131 SER K 153 145 LYS H Protein S 2 FT #SUB 133 133 VAL K 134 124 LEU H Protein S 1 FT #SUB 135 135 LEU K 176 174 PHE H Protein S 2 FT #SUB 135 135 LEU K 191 190 VAL H Protein S 1 FT #SUB 137 137 ASN K 174 172 HIS H Protein S 2 FT #SUB 137 137 ASN K 193 192 THR H Protein S 2 FT #SUB 138 138 ASN K 174 172 HIS H Protein S 4 FT #SUB 160 160 GLN K 179 177 VAL H Protein S 1 FT #SUB 160 160 GLN K 180 178 LEU H Protein S 4 FT #SUB 160 160 GLN K 181 179 GLN H Protein S 2 FT #SUB 161 161 GLU K 179 177 VAL H Protein B 1 FT #SUB 162 162 SER K 176 174 PHE H Protein A 2 FT #SUB 162 162 SER K 177 175 PRO H Protein S 6 FT #SUB 163 163 VAL K 177 175 PRO H Protein B 3 FT #SUB 164 164 THR K 175 173 THR H Protein S 1 FT #SUB 164 164 THR K 176 174 PHE H Protein S 2 FT #SUB 167 167 ASP K 174 172 HIS H Protein S 1 FT #SUB 174 174 SER K 174 172 HIS H Protein S 3 FT #SUB 174 174 SER K 176 174 PHE H Protein A 4 FT #SUB 175 175 LEU K 176 174 PHE H Protein B 4 FT #SUB 176 176 SER K 176 174 PHE H Protein A 8 FT #SUB 176 176 SER K 189 188 SER H Protein S 2 FT #SUB 32 32 TRP K 107 100C ASN M Protein S 6 FT #SUB 36 36 TYR K 109 100E PRO M Protein S 2 FT #SUB 36 36 TYR K 110 100F PHE M Protein S 6 FT #SUB 36 36 TYR K 113 103 TRP M Protein S 2 FT #SUB 38 38 GLN K 39 39 ARG M Protein S 12 FT #SUB 38 38 GLN K 45 45 LEU M Protein S 1 FT #SUB 38 38 GLN K 95 91 TYR M Protein S 2 FT #SUB 42 42 LYS K 95 91 TYR M Protein B 1 FT #SUB 43 43 ALA K 114 104 GLY M Protein S 1 FT #SUB 44 44 PRO K 45 45 LEU M Protein S 1 FT #SUB 44 44 PRO K 95 91 TYR M Protein S 1 FT #SUB 44 44 PRO K 113 103 TRP M Protein A 7 FT #SUB 46 46 LEU K 109 100E PRO M Protein S 2 FT #SUB 46 46 LEU K 110 100F PHE M Protein S 2 FT #SUB 46 46 LEU K 111 101 ASP M Protein S 1 FT #SUB 49 49 TYR K 109 100E PRO M Protein S 2 FT #SUB 55 55 LYS K 101 97 SER M Protein S 1 FT #SUB 55 55 LYS K 102 98 ASP M Protein S 1 FT #SUB 85 85 THR K 39 39 ARG M Protein S 3 FT #SUB 87 87 HIS K 43 43 GLY M Protein S 1 FT #SUB 87 87 HIS K 45 45 LEU M Protein S 7 FT #SUB 89 89 GLN K 110 100F PHE M Protein S 6 FT #SUB 91 91 TYR K 107 100C ASN M Protein A 12 FT #SUB 91 91 TYR K 108 100D ASP M Protein S 3 FT #SUB 91 91 TYR K 109 100E PRO M Protein S 2 FT #SUB 92 92 ALA K 99 95 LYS M Protein B 3 FT #SUB 92 92 ALA K 107 100C ASN M Protein B 7 FT #SUB 93 93 GLY K 99 95 LYS M Protein B 4 FT #SUB 93 93 GLY K 106 100B ASP M Protein B 1 FT #SUB 93 93 GLY K 107 100C ASN M Protein B 3 FT #SUB 94 94 TYR K 33 33 THR M Protein S 1 FT #SUB 94 94 TYR K 47 47 TRP M Protein B 1 FT #SUB 94 94 TYR K 50 50 SER M Protein B 5 FT #SUB 94 94 TYR K 52 52 SER M Protein S 3 FT #SUB 94 94 TYR K 57 56 TYR M Protein S 4 FT #SUB 94 94 TYR K 59 58 ASP M Protein B 2 FT #SUB 95 95 SER K 47 47 TRP M Protein A 5 FT #SUB 95 95 SER K 59 58 ASP M Protein S 1 FT #SUB 96 96 ALA K 47 47 TRP M Protein B 7 FT #SUB 98 98 PHE K 45 45 LEU M Protein S 4 FT #SUB 98 98 PHE K 47 47 TRP M Protein S 2 FT #SUB 100 100 GLN K 44 44 GLY M Protein B 2 FT #SUB 94 94 TYR K 30 30 TRP C Protein S 2 FT #SUB 94 94 TYR K 32 32 PRO C Protein S 2 FT #HET 93 93 GLY K 13 4 MAN D B 3 FT #HET 94 94 TYR K 10 1 BMA D S 1 FT #HET 94 94 TYR K 11 2 MAN D S 1 FT #HET 94 94 TYR K 13 4 MAN D S 2 FT #HET 160 160 GLN K 19 301 GOL K B 1 FT #HET 162 162 SER K 19 301 GOL K S 2 FT #HET 176 176 SER K 19 301 GOL K A 5 FT #HET 177 177 SER K 19 301 GOL K B 3 FT #HET 178 178 THR K 19 301 GOL K A 8 CC SEQUENCE 213 AA (ATOM); CC AVVMTQSPST LSASVGDTIT ITCRASQSIE TWLAWYQQKP GKAPKLLIYK ASTLKTGVPS CC RFSGSGSGTE FTLTISGLQF DDFATYHCQH YAGYSATFGQ GTRVEIKRTV AAPSVFIFPP CC SDEQLKSGTA SVVCLLNNFY PREAKVQWKV DNALQSGNSQ ESVTEQDSKD STYSLSSTLT CC LSKADYEKHK VYACEVTHQG LSSPVTKSFN RGE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AVVMTQSPSTLSASVGDTITITCRASQSIETWLAWYQQKPGKAPKLLIYK CC ATOM AVVMTQSPSTLSASVGDTITITCRASQSIETWLAWYQQKPGKAPKLLIYK CC ************************************************** CC SEQRES ASTLKTGVPSRFSGSGSGTEFTLTISGLQFDDFATYHCQHYAGYSATFGQ CC ATOM ASTLKTGVPSRFSGSGSGTEFTLTISGLQFDDFATYHCQHYAGYSATFGQ CC ************************************************** CC SEQRES GTRVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKV CC ATOM GTRVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKV CC ************************************************** CC SEQRES DNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQG CC ATOM DNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQG CC ************************************************** CC SEQRES LSSPVTKSFNRGE CC ATOM LSSPVTKSFNRGE CC ************* SQ SEQUENCE 213 AA; MW; CN; AVVMTQSPST LSASVGDTIT ITCRASQSIE TWLAWYQQKP GKAPKLLIYK ASTLKTGVPS RFSGSGSGTE FTLTISGLQF DDFATYHCQH YAGYSATFGQ GTRVEIKRTV AAPSVFIFPP SDEQLKSGTA SVVCLLNNFY PREAKVQWKV DNALQSGNSQ ESVTEQDSKD STYSLSSTLT LSKADYEKHK VYACEVTHQG LSSPVTKSFN RGE // ID 6CXGM STANDARD; PRT; 224 AA. DT CONVERTED FROM PDB (SEQRES) 6CXG DE anti-HIV-1 Fab 2g12 heavy chain OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.199 FT #SUB 132 122 PHE M 121 121 SER L Protein S 3 FT #SUB 132 122 PHE M 123 123 GLU L Protein S 3 FT #SUB 132 122 PHE M 124 124 GLN L Protein S 9 FT #SUB 133 123 PRO M 121 121 SER L Protein A 2 FT #SUB 134 124 LEU M 118 118 PHE L Protein A 7 FT #SUB 135 125 ALA M 118 118 PHE L Protein B 2 FT #SUB 139 129 LYS M 117 117 ILE L Protein A 6 FT #SUB 139 129 LYS M 208 208 SER L Protein S 2 FT #SUB 139 129 LYS M 209 209 PHE L Protein S 2 FT #SUB 140 130 SER M 116 116 PHE L Protein B 5 FT #SUB 140 130 SER M 118 118 PHE L Protein S 2 FT #SUB 147 139 ALA M 116 116 PHE L Protein S 5 FT #SUB 147 139 ALA M 118 118 PHE L Protein B 3 FT #SUB 151 143 LEU M 131 131 SER L Protein S 2 FT #SUB 153 145 LYS M 124 124 GLN L Protein S 2 FT #SUB 153 145 LYS M 131 131 SER L Protein S 1 FT #SUB 174 172 HIS M 137 137 ASN L Protein S 3 FT #SUB 174 172 HIS M 138 138 ASN L Protein S 4 FT #SUB 174 172 HIS M 167 167 ASP L Protein S 1 FT #SUB 174 172 HIS M 174 174 SER L Protein S 5 FT #SUB 176 174 PHE M 135 135 LEU L Protein S 2 FT #SUB 176 174 PHE M 162 162 SER L Protein A 4 FT #SUB 176 174 PHE M 164 164 THR L Protein S 2 FT #SUB 176 174 PHE M 174 174 SER L Protein S 2 FT #SUB 176 174 PHE M 175 175 LEU L Protein S 7 FT #SUB 176 174 PHE M 176 176 SER L Protein S 9 FT #SUB 177 175 PRO M 162 162 SER L Protein A 8 FT #SUB 177 175 PRO M 163 163 VAL L Protein S 3 FT #SUB 179 177 VAL M 160 160 GLN L Protein S 1 FT #SUB 179 177 VAL M 161 161 GLU L Protein S 1 FT #SUB 180 178 LEU M 160 160 GLN L Protein B 1 FT #SUB 181 179 GLN M 160 160 GLN L Protein S 1 FT #SUB 191 190 VAL M 135 135 LEU L Protein S 2 FT #SUB 193 192 THR M 137 137 ASN L Protein S 1 FT #SUB 219 221 LYS M 123 123 GLU L Protein S 4 FT #SUB 7 7 SER M 84 82A HIS H Protein S 2 FT #SUB 11 11 LEU M 181 179 GLN H Protein S 1 FT #SUB 11 11 LEU M 182 180 SER H Protein S 1 FT #SUB 11 11 LEU M 184 183 GLY H Protein S 2 FT #SUB 19 19 ILE M 7 7 SER H Protein S 1 FT #SUB 19 19 ILE M 19 19 ILE H Protein A 6 FT #SUB 19 19 ILE M 20 20 LEU H Protein S 2 FT #SUB 19 19 ILE M 21 21 SER H Protein S 4 FT #SUB 21 21 SER M 19 19 ILE H Protein S 3 FT #SUB 21 21 SER M 82 81 GLN H Protein S 3 FT #SUB 55 54 SER M 75 74 LEU H Protein A 2 FT #SUB 58 57 ARG M 73 72 ASP H Protein S 8 FT #SUB 58 57 ARG M 75 74 LEU H Protein S 1 FT #SUB 58 57 ARG M 76 75 GLU H Protein S 12 FT #SUB 69 68 THR M 76 75 GLU H Protein S 1 FT #SUB 69 68 THR M 78 77 PHE H Protein S 1 FT #SUB 71 70 SER M 73 72 ASP H Protein S 4 FT #SUB 71 70 SER M 80 79 TYR H Protein S 6 FT #SUB 73 72 ASP M 58 57 ARG H Protein S 8 FT #SUB 73 72 ASP M 71 70 SER H Protein S 4 FT #SUB 75 74 LEU M 54 53 SER H Protein S 1 FT #SUB 75 74 LEU M 55 54 SER H Protein S 3 FT #SUB 75 74 LEU M 58 57 ARG H Protein S 1 FT #SUB 76 75 GLU M 58 57 ARG H Protein S 13 FT #SUB 76 75 GLU M 69 68 THR H Protein S 4 FT #SUB 78 77 PHE M 69 68 THR H Protein S 2 FT #SUB 78 77 PHE M 82 81 GLN H Protein S 7 FT #SUB 80 79 TYR M 19 19 ILE H Protein S 1 FT #SUB 80 79 TYR M 71 70 SER H Protein S 6 FT #SUB 80 79 TYR M 80 79 TYR H Protein S 11 FT #SUB 80 79 TYR M 82 81 GLN H Protein S 6 FT #SUB 82 81 GLN M 21 21 SER H Protein S 3 FT #SUB 82 81 GLN M 78 77 PHE H Protein S 7 FT #SUB 82 81 GLN M 80 79 TYR H Protein S 6 FT #SUB 84 82A HIS M 7 7 SER H Protein S 2 FT #SUB 180 178 LEU M 120 110 THR H Protein S 1 FT #SUB 181 179 GLN M 11 11 LEU H Protein B 1 FT #SUB 182 180 SER M 11 11 LEU H Protein B 3 FT #SUB 184 183 GLY M 11 11 LEU H Protein B 2 FT #SUB 33 33 THR M 94 94 TYR K Protein S 1 FT #SUB 39 39 ARG M 38 38 GLN K Protein S 12 FT #SUB 39 39 ARG M 85 85 THR K Protein S 3 FT #SUB 43 43 GLY M 87 87 HIS K Protein B 1 FT #SUB 44 44 GLY M 100 100 GLN K Protein B 2 FT #SUB 45 45 LEU M 38 38 GLN K Protein S 1 FT #SUB 45 45 LEU M 44 44 PRO K Protein S 1 FT #SUB 45 45 LEU M 87 87 HIS K Protein S 7 FT #SUB 45 45 LEU M 98 98 PHE K Protein A 4 FT #SUB 47 47 TRP M 94 94 TYR K Protein S 1 FT #SUB 47 47 TRP M 95 95 SER K Protein S 5 FT #SUB 47 47 TRP M 96 96 ALA K Protein S 7 FT #SUB 47 47 TRP M 98 98 PHE K Protein B 2 FT #SUB 50 50 SER M 94 94 TYR K Protein S 5 FT #SUB 52 52 SER M 94 94 TYR K Protein A 3 FT #SUB 57 56 TYR M 94 94 TYR K Protein S 4 FT #SUB 59 58 ASP M 94 94 TYR K Protein S 2 FT #SUB 59 58 ASP M 95 95 SER K Protein S 1 FT #SUB 95 91 TYR M 38 38 GLN K Protein S 2 FT #SUB 95 91 TYR M 42 42 LYS K Protein S 1 FT #SUB 95 91 TYR M 44 44 PRO K Protein S 1 FT #SUB 99 95 LYS M 92 92 ALA K Protein S 3 FT #SUB 99 95 LYS M 93 93 GLY K Protein S 4 FT #SUB 101 97 SER M 55 55 LYS K Protein S 1 FT #SUB 102 98 ASP M 55 55 LYS K Protein S 1 FT #SUB 106 100B ASP M 93 93 GLY K Protein B 1 FT #SUB 107 100C ASN M 32 32 TRP K Protein A 6 FT #SUB 107 100C ASN M 91 91 TYR K Protein A 12 FT #SUB 107 100C ASN M 92 92 ALA K Protein S 7 FT #SUB 107 100C ASN M 93 93 GLY K Protein S 3 FT #SUB 108 100D ASP M 91 91 TYR K Protein B 3 FT #SUB 109 100E PRO M 36 36 TYR K Protein A 2 FT #SUB 109 100E PRO M 46 46 LEU K Protein S 2 FT #SUB 109 100E PRO M 49 49 TYR K Protein S 2 FT #SUB 109 100E PRO M 91 91 TYR K Protein B 2 FT #SUB 110 100F PHE M 36 36 TYR K Protein A 6 FT #SUB 110 100F PHE M 46 46 LEU K Protein B 2 FT #SUB 110 100F PHE M 89 89 GLN K Protein S 6 FT #SUB 111 101 ASP M 46 46 LEU K Protein B 1 FT #SUB 113 103 TRP M 36 36 TYR K Protein S 2 FT #SUB 113 103 TRP M 44 44 PRO K Protein S 7 FT #SUB 114 104 GLY M 43 43 ALA K Protein B 1 FT #SUB 28 28 ARG M 19 19 ILE A Protein S 2 FT #SUB 28 28 ARG M 21 21 ARG A Protein S 2 FT #SUB 75 74 LEU M 19 19 ILE A Protein B 1 FT #SUB 76 75 GLU M 21 21 ARG A Protein A 5 FT #SUB 76 75 GLU M 22 22 SER A Protein S 9 FT #SUB 76 75 GLU M 28 28 TYR A Protein S 5 FT #SUB 77 76 ASP M 21 21 ARG A Protein S 3 FT #SUB 78 77 PHE M 23 23 ILE A Protein S 2 FT #SUB 56 55 THR M 20 20 FOD C Protein A 2 FT #SUB 56 55 THR M 28 28 TYR C Protein B 1 FT #SUB 57 56 TYR M 26 26 TYR C Protein S 3 FT #SUB 57 56 TYR M 30 30 TRP C Protein S 6 FT #SUB 57 56 TYR M 32 32 PRO C Protein S 4 FT #SUB 58 57 ARG M 22 22 SER C Protein S 1 FT #SUB 58 57 ARG M 26 26 TYR C Protein B 4 FT #SUB 58 57 ARG M 28 28 TYR C Protein A 10 FT #SUB 59 58 ASP M 26 26 TYR C Protein A 2 FT #SUB 60 59 TYR M 22 22 SER C Protein S 6 FT #SUB 60 59 TYR M 26 26 TYR C Protein S 4 FT #SUB 65 64 LYS M 26 26 TYR C Protein S 7 FT #SUB 66 65 GLY M 22 22 SER C Protein B 2 FT #SUB 66 65 GLY M 23 23 ILE C Protein B 3 FT #SUB 66 65 GLY M 24 24 PRO C Protein B 6 FT #SUB 67 66 ARG M 23 23 ILE C Protein B 3 FT #SUB 68 67 PHE M 22 22 SER C Protein B 1 FT #SUB 68 67 PHE M 23 23 ILE C Protein B 3 FT #SUB 69 68 THR M 22 22 SER C Protein S 1 FT #SUB 69 68 THR M 23 23 ILE C Protein S 4 FT #SUB 84 82A HIS M 23 23 ILE C Protein S 2 FT #HET 31 31 ALA M 12 3 MAN D A 7 FT #HET 31 31 ALA M 13 4 MAN D B 2 FT #HET 32 32 HIS M 13 4 MAN D B 3 FT #HET 33 33 THR M 13 4 MAN D A 15 FT #HET 53 52A THR M 11 2 MAN D A 12 FT #HET 53 52A THR M 12 3 MAN D S 1 FT #HET 54 53 SER M 11 2 MAN D S 3 FT #HET 54 53 SER M 14 5 MAN D S 1 FT #HET 56 55 THR M 10 1 BMA D S 1 FT #HET 56 55 THR M 14 5 MAN D S 1 FT #HET 99 95 LYS M 13 4 MAN D A 11 FT #HET 100 96 GLY M 13 4 MAN D B 2 FT #HET 104 100 LEU M 12 3 MAN D S 1 FT #HET 104 100 LEU M 13 4 MAN D S 1 FT #HET 105 100A SER M 12 3 MAN D B 1 FT #HET 105 100A SER M 13 4 MAN D B 5 FT #HET 106 100B ASP M 12 3 MAN D A 5 FT #HET 106 100B ASP M 13 4 MAN D B 3 FT #HET 106 100B ASP M 16 7 MAN D S 1 FT #HET 107 100C ASN M 13 4 MAN D B 3 FT #HET 108 100D ASP M 13 4 MAN D A 8 FT #HET 176 174 PHE M 17 301 GOL L A 4 FT #HET 177 175 PRO M 17 301 GOL L B 1 FT #HET 179 177 VAL M 17 301 GOL L S 3 FT #HET 187 186 SER M 17 301 GOL L A 3 FT #HET 188 187 LEU M 17 301 GOL L A 6 FT #HET 189 188 SER M 17 301 GOL L B 2 CC SEQUENCE 224 AA (ATOM); CC EVQLVESGGG LVKAGGSLIL SCGVSNFRIS AHTMNWVRRV PGGGLEWVAS ISTSSTYRDY CC ADAVKGRFTV SRDDLEDFVY LQMHKMRVED TAIYYCARKG SDRLSDNDPF DAWGPGTVVT CC VSPASTKGPS VFPLAPSSKS TSGGTAALGC LVKDYFPEPV TVSWNSGALT SGVHTFPAVL CC QSSGLYSLSS VVTVPSSSLG TQTYICNVNH KPSNTKVDKK VEPK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES EVQLVESGGGLVKAGGSLILSCGVSNFRISAHTMNWVRRVPGGGLEWVAS CC ATOM EVQLVESGGGLVKAGGSLILSCGVSNFRISAHTMNWVRRVPGGGLEWVAS CC ************************************************** CC SEQRES ISTSSTYRDYADAVKGRFTVSRDDLEDFVYLQMHKMRVEDTAIYYCARKG CC ATOM ISTSSTYRDYADAVKGRFTVSRDDLEDFVYLQMHKMRVEDTAIYYCARKG CC ************************************************** CC SEQRES SDRLSDNDPFDAWGPGTVVTVSPASTKGPSVFPLAPSSKSTSGGTAALGC CC ATOM SDRLSDNDPFDAWGPGTVVTVSPASTKGPSVFPLAPSSKSTSGGTAALGC CC ************************************************** CC SEQRES LVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLG CC ATOM LVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLG CC ************************************************** CC SEQRES TQTYICNVNHKPSNTKVDKKVEPK CC ATOM TQTYICNVNHKPSNTKVDKKVEPK CC ************************ SQ SEQUENCE 224 AA; MW; CN; EVQLVESGGG LVKAGGSLIL SCGVSNFRIS AHTMNWVRRV PGGGLEWVAS ISTSSTYRDY ADAVKGRFTV SRDDLEDFVY LQMHKMRVED TAIYYCARKG SDRLSDNDPF DAWGPGTVVT VSPASTKGPS VFPLAPSSKS TSGGTAALGC LVKDYFPEPV TVSWNSGALT SGVHTFPAVL QSSGLYSLSS VVTVPSSSLG TQTYICNVNH KPSNTKVDKK VEPK // ID 6CXGA STANDARD; PRT; 40 AA. DT CONVERTED FROM PDB (SEQRES) 6CXG DE 10V1S glycopeptide OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.199 FT #SUB 30 30 TRP A 94 94 TYR L Protein S 3 FT #SUB 32 32 PRO A 94 94 TYR L Protein S 1 FT #SUB 20 20 FOD A 56 55 THR H Protein S 6 FT #SUB 22 22 SER A 58 57 ARG H Protein S 1 FT #SUB 22 22 SER A 60 59 TYR H Protein S 6 FT #SUB 22 22 SER A 66 65 GLY H Protein B 2 FT #SUB 22 22 SER A 68 67 PHE H Protein S 1 FT #SUB 22 22 SER A 69 68 THR H Protein S 3 FT #SUB 23 23 ILE A 66 65 GLY H Protein A 4 FT #SUB 23 23 ILE A 67 66 ARG H Protein S 2 FT #SUB 23 23 ILE A 68 67 PHE H Protein S 3 FT #SUB 23 23 ILE A 82 81 GLN H Protein S 1 FT #SUB 23 23 ILE A 84 82A HIS H Protein S 2 FT #SUB 24 24 PRO A 66 65 GLY H Protein B 5 FT #SUB 26 26 TYR A 57 56 TYR H Protein S 3 FT #SUB 26 26 TYR A 58 57 ARG H Protein S 5 FT #SUB 26 26 TYR A 59 58 ASP H Protein S 3 FT #SUB 26 26 TYR A 60 59 TYR H Protein S 4 FT #SUB 26 26 TYR A 65 64 LYS H Protein S 8 FT #SUB 28 28 TYR A 56 55 THR H Protein S 2 FT #SUB 28 28 TYR A 58 57 ARG H Protein S 11 FT #SUB 30 30 TRP A 57 56 TYR H Protein A 7 FT #SUB 32 32 PRO A 57 56 TYR H Protein S 2 FT #SUB 19 19 ILE A 28 28 ARG M Protein S 2 FT #SUB 19 19 ILE A 75 74 LEU M Protein S 1 FT #SUB 21 21 ARG A 28 28 ARG M Protein S 2 FT #SUB 21 21 ARG A 76 75 GLU M Protein A 5 FT #SUB 21 21 ARG A 77 76 ASP M Protein S 3 FT #SUB 22 22 SER A 76 75 GLU M Protein A 9 FT #SUB 23 23 ILE A 78 77 PHE M Protein S 2 FT #SUB 28 28 TYR A 76 75 GLU M Protein S 5 FT #HET 30 30 TRP A 1 1 BMA B S 3 FT #HET 30 30 TRP A 2 2 MAN B S 1 FT #HET 33 33 ASN A 2 2 MAN B S 4 FT #HET 33 33 ASN A 3 3 MAN B A 6 FT #MOD 20 20 FOD A 1 1 BMA B S FT DISORDER 1 17 FT DISORDER 34 40 CC SEQUENCE 16 AA (ATOM); CC TIXRSIPWYT YRWLPN CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XATKTNSKREKTXDNHVTIXRSIPWYTYRWLPNGSGSGXA CC ATOM -----------------TIXRSIPWYTYRWLPN------- CC **************** SQ SEQUENCE 40 AA; MW; CN; XATKTNSKRE KTXDNHVTIX RSIPWYTYRW LPNGSGSGXA // ID 6CXGC STANDARD; PRT; 40 AA. DT CONVERTED FROM PDB (SEQRES) 6CXG DE 10V1S glycopeptide OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.199 FT #SUB 19 19 ILE C 28 28 ARG H Protein S 5 FT #SUB 19 19 ILE C 75 74 LEU H Protein S 1 FT #SUB 20 20 FOD C 76 75 GLU H Protein B 2 FT #SUB 21 21 ARG C 28 28 ARG H Protein S 4 FT #SUB 21 21 ARG C 76 75 GLU H Protein A 5 FT #SUB 21 21 ARG C 77 76 ASP H Protein S 3 FT #SUB 22 22 SER C 76 75 GLU H Protein A 10 FT #SUB 23 23 ILE C 78 77 PHE H Protein S 2 FT #SUB 28 28 TYR C 76 75 GLU H Protein S 5 FT #SUB 30 30 TRP C 94 94 TYR K Protein S 2 FT #SUB 32 32 PRO C 94 94 TYR K Protein S 2 FT #SUB 20 20 FOD C 56 55 THR M Protein S 2 FT #SUB 22 22 SER C 58 57 ARG M Protein S 1 FT #SUB 22 22 SER C 60 59 TYR M Protein S 6 FT #SUB 22 22 SER C 66 65 GLY M Protein B 2 FT #SUB 22 22 SER C 68 67 PHE M Protein S 1 FT #SUB 22 22 SER C 69 68 THR M Protein S 1 FT #SUB 23 23 ILE C 66 65 GLY M Protein S 3 FT #SUB 23 23 ILE C 67 66 ARG M Protein S 3 FT #SUB 23 23 ILE C 68 67 PHE M Protein S 3 FT #SUB 23 23 ILE C 69 68 THR M Protein S 4 FT #SUB 23 23 ILE C 84 82A HIS M Protein S 2 FT #SUB 24 24 PRO C 66 65 GLY M Protein B 6 FT #SUB 26 26 TYR C 57 56 TYR M Protein S 3 FT #SUB 26 26 TYR C 58 57 ARG M Protein S 4 FT #SUB 26 26 TYR C 59 58 ASP M Protein S 2 FT #SUB 26 26 TYR C 60 59 TYR M Protein S 4 FT #SUB 26 26 TYR C 65 64 LYS M Protein S 7 FT #SUB 28 28 TYR C 56 55 THR M Protein S 1 FT #SUB 28 28 TYR C 58 57 ARG M Protein S 10 FT #SUB 30 30 TRP C 57 56 TYR M Protein A 6 FT #SUB 32 32 PRO C 57 56 TYR M Protein S 4 FT #HET 30 30 TRP C 10 1 BMA D S 1 FT #HET 30 30 TRP C 15 6 MAN D S 1 FT #MOD 20 20 FOD C 10 1 BMA D S FT DISORDER 1 18 FT DISORDER 33 40 CC SEQUENCE 14 AA (ATOM); CC IXRSIPWYTY RWLP CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XATKTNSKREKTXDNHVTIXRSIPWYTYRWLPNGSGSGXA CC ATOM ------------------IXRSIPWYTYRWLP-------- CC ************** SQ SEQUENCE 40 AA; MW; CN; XATKTNSKRE KTXDNHVTIX RSIPWYTYRW LPNGSGSGXA //