Structure of PDB 2w6d Chain B Binding Site BS10 |
>2w6d Chain B (length=680) Species: 63737 (Nostoc punctiforme PCC 73102)
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VNQVATDRFIQDLERVAQVRSEMSVCLNKLAETINKAELAGDSSSGKLSL ERDIEDITIASKNLQQGVFRLLVLGDMKRGKSTFLNALIGENLLPSTAVL TVLRYGPEKKVTIHFNDGKSPQQLDFQNFKYKYTIDPAEAKKLEQEKKQA FPDVDYAVVEYPLTLLQKGIEIVDSPGLNDTEARNELSLGYVNNCHAILF VMRASQPCTLGERRYLENYIKGRGLTVFFLVNAWDQVRESLIDPDDVEEL QASENRLRQVFNANLAEYCTVEGQNIYDERVFELSSIQALRRRLKNPQAD LDGTGFPKFMDSLNTFLTRERAIAELRQVRTLARLACNHTREAVARRIPL LEQDVNELKKRIDSVEPEFNKLTGIRDEFQKEIINTRDTQARTISESFRS YVLNLGNTFENDFLRYQPELNLFDFLSSGKREAFNAALQKAFEQYITDKS AAWTLTAEKDINAAFKELSRSASQYGASYNQITDQITEKLTGKDVEDNSP GWAKWAMGLLSLSKGNLAGFALAGAGFDWKNILLNYFTVIGIGGIITAVT GILLGPIGFALLGLGVGFLQADQARRELVKTAKKELVKHLPQVAHEQSQV VYNAVKECFDSYEREVSKRINDDIVSRKSELDNLVKQKQTREINRESEFN RLKNLQEDVIAQLQKIEAAYSNLLAYYSHH |
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Ligand ID | CPL |
InChI | InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h14,16,20-21,40H,6-13,15,17-19,22-39H2,1-5H3/b16-14-,21-20-/t40-/m1/s1 |
InChIKey | JLPULHDHAOZNQI-ZTIMHPMXSA-N |
SMILES | Software | SMILES |
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ACDLabs 10.04 | O=C(OCC(OC(=O)CCCCCCC\C=C/C\C=C/CCCCC)COP([O-])(=O)OCC[N+](C)(C)C)CCCCCCCCCCCCCCC | OpenEye OEToolkits 1.5.0 | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC | CACTVS 3.341 | CCCCCCCCCCCCCCCC(=O)OC[CH](CO[P]([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC | CACTVS 3.341 | CCCCCCCCCCCCCCCC(=O)OC[C@H](CO[P]([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/C/C=C\CCCCC | OpenEye OEToolkits 1.5.0 | CCCCCCCCCCCCCCCC(=O)OC[C@H](CO[P@@](=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC |
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Formula | C42 H80 N O8 P |
Name | 1-PALMITOYL-2-LINOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE; PALMITOYL-LINOLEOYL PHOSPHATIDYLCHOLINE |
ChEMBL | |
DrugBank | DB02306 |
ZINC |
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PDB chain | 2w6d Chain B Residue 1704
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Enzyme Commision number |
3.6.5.5: dynamin GTPase. |
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