Structure of PDB 7pp7 Chain A Binding Site BS01

Receptor Information
>7pp7 Chain A (length=311) Species: 32198 (Thunbergia alata) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EKAEIFNSMHGWVEDTILPFLKPVEESWQPTDFLPDSTSDGFHEQVEELR
KRTADLPDDYLVALVGAMVTEEALPTYQTMLNTTDVIYDESGASPVPWAV
WTRAWTAEENRHGDIVNKYLYLSGRVDMKQIEKTIQYLIGSGDNNPYLAY
IYTSYQERATAISHGSLGRLARQKGEMKLAQICGTISADEKRHEAAYSKI
VEKLFELDPEGTMLALAYMMKMKIVMPDMFQHFSAVSQRLGIYTAKEYTD
ILEHMIARWGVDKLTGLSGEGRRAQDYVCGLPMRFRKVEERAQAWAENIS
HVPFSWIFGRR
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain7pp7 Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7pp7 Regioselectivity mechanism of the Thunbergia alata Delta 6-16:0-acyl carrier protein desaturase.
Resolution2.05 Å
Binding residue
(original residue number in PDB)		E100 E138 H141 E224
Binding residue
(residue number reindexed from 1)		E71 E109 H112 E190
Annotation score1
Enzymatic activity
Enzyme Commision number 1.14.19.26: acyl-[acyl-carrier-protein] 6-desaturase.
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity
GO:0045300 stearoyl-[ACP] desaturase activity
Biological Process
GO:0006631 fatty acid metabolic process

View graph for
Molecular Function
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Biological Process
External links
PDB RCSB:7pp7, PDBe:7pp7, PDBj:7pp7
PDBsum7pp7
PubMed34893899
UniProtQ41510|PALAD_THUAT Acyl-[acyl-carrier-protein] 6-desaturase

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