Structure of PDB 6p5q Chain A Binding Site BS02

Receptor Information
>6p5q Chain A (length=252) Species: 294 (Pseudomonas fluorescens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DTFSRTGPLMEAASYPAWTQQLIQDCSESKRRVVEHELYQRMRDNKLSAK
VMRQYLIGGWPVVEQFALYMAQNLTKTRFARHPGEDMARRWLMRNIRVEL
NHADYWVHWSRAHGVTLEDLQAQQVPPELHALSHWCWHTSSADSLIVAIA
ATNYAIEGATGEWSALVCSNGIYAAAFPEEDRKRAMKWLKMHADAHPWEA
LEIIVTLAGLNPTKALQAELRQAICKSYDYMYLFLERCMQQEKTAVTRER
LA
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 chain6p5q Chain A Residue 303 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB6p5q Substrate-Triggered Formation of a Peroxo-Fe2(III/III) Intermediate during Fatty Acid Decarboxylation by UndA.
Resolution1.86 Å
Binding residue
(original residue number in PDB)		E101 H104 H194
Binding residue
(residue number reindexed from 1)		E99 H102 H192
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) P128 P217
Catalytic site (residue number reindexed from 1) P126 P212
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6p5q, PDBe:6p5q, PDBj:6p5q
PDBsum6p5q
PubMed31487162
UniProtQ4K8M0

[Back to BioLiP]