Structure of PDB 4v0j Chain A Binding Site BS01

Receptor Information
>4v0j Chain A (length=324) Species: 3988 (Ricinus communis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PPQKIEIFKSLDNWAEENILVHLKPVEKCWQPQDFLPDPASDGFDEQVRE
LRERAKEIPDDYFVVLVGDMIKEEALPTYQTMLNTLDGVRDETGASPTSW
AIWTRAWTAEENRHGDLLNKYLYLSGRVDMRQIEKTIQYLIGSGMDPRTE
NSPYLGFIYTSFQERATFIEHGNTARQAKEHGDIKLAQICGTIAADEKRH
ETAYTKIVEKLFEIDPDGTVLAFADMMRKKISMPAHLMYDGRDDNLFDHF
SAVAQRLGVYTAKDYADILEFLVGRWKVDKLTGLSAEGQKAQDYVCRLPP
RIRRLEERAPTMPFSWIFDRQVKL
Ligand information
Ligand IDFE2
InChIInChI=1S/Fe/q+2
InChIKeyCWYNVVGOOAEACU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Fe+2]
CACTVS 3.341[Fe++]
FormulaFe
NameFE (II) ION
ChEMBL
DrugBankDB14510
ZINC
PDB chain4v0j Chain A Residue 364 [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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PDB4v0j Half-of-the-Sites Reactivity of the Castor Delta9-18:0-Acp Desaturase.
Resolution2.8 Å
Binding residue
(original residue number in PDB)		E105 E143 H146 E229
Binding residue
(residue number reindexed from 1)		E73 E111 H114 E197
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) W62 E105 E143 H146 E196 T199 D228 E229 H232
Catalytic site (residue number reindexed from 1) W30 E73 E111 H114 E164 T167 D196 E197 H200
Enzyme Commision number 1.14.19.2: stearoyl-[acyl-carrier-protein] 9-desaturase.
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity
GO:0045300 stearoyl-[ACP] desaturase activity
Biological Process
GO:0006631 fatty acid metabolic process
GO:0006633 fatty acid biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:4v0j, PDBe:4v0j, PDBj:4v0j
PDBsum4v0j
PubMed26224800
UniProtP22337|STAD_RICCO Stearoyl-[acyl-carrier-protein] 9-desaturase, chloroplastic

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