Structure of PDB 5lnk Chain X Binding Site BS01

Receptor Information
>5lnk Chain X (length=88) Species: 9940 (Ovis aries) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SDAPPLTLEGIKDRVLYVLKLYDKIDPEKLSVNSHFMKDLGLDSLDQVEI
IMAMEDEFGFEIPDIDAEKLMCPQEIVDYIADKKDVYE
Ligand information
Ligand IDPNS
InChIInChI=1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)/t9-/m0/s1
InChIKeyJDMUPRLRUUMCTL-VIFPVBQESA-N
SMILES
SoftwareSMILES
CACTVS 3.341CC(C)(CO[P](O)(O)=O)[C@@H](O)C(=O)NCCC(=O)NCCS
ACDLabs 10.04O=C(NCCS)CCNC(=O)C(O)C(C)(C)COP(=O)(O)O
OpenEye OEToolkits 1.5.0CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O
OpenEye OEToolkits 1.5.0CC(C)(COP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O
CACTVS 3.341CC(C)(CO[P](O)(O)=O)[CH](O)C(=O)NCCC(=O)NCCS
FormulaC11 H23 N2 O7 P S
Name4'-PHOSPHOPANTETHEINE
ChEMBL
DrugBankDB03912
ZINC
PDB chain5lnk Chain X Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5lnk Atomic structure of the entire mammalian mitochondrial complex I.
Resolution3.9 Å
Binding residue
(original residue number in PDB)		D43 S44 L45
Binding residue
(residue number reindexed from 1)		D43 S44 L45
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) D43
Catalytic site (residue number reindexed from 1) D43
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0006633 fatty acid biosynthetic process

View graph for
Biological Process
External links
PDB RCSB:5lnk, PDBe:5lnk, PDBj:5lnk
PDBsum5lnk
PubMed27595392
UniProtW5NQT7

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