Structure of PDB 6cys Chain A Binding Site BS01

Receptor Information
>6cys Chain A (length=209) Species: 431241 (Trichoderma reesei QM6a) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GTFSLPALPYAYDALEPSISAQIMELHHSKHHQTYVTNLNNALKTYSTAL
AANDVPSQIALQAAIKFNGGGHINHSLFWENLCPASSPDADPASAPELTA
EIAKTWGSLDKFKEAMGKALLGIQGSGWGWLVKEGSGLRIVTTKDQGPVV
GGEVPVFGIDMWEHAYYLQYLNGKAAYVDNIWKVINWKTAEQRFKGDRED
AFKILKASL
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 chain6cys Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6cys Crystal structure analysis of the D150G mutant of Superoxide Dismutase from Trichoderma reesei
Resolution1.85 Å
Binding residue
(original residue number in PDB)		H30 H78 D163 H167
Binding residue
(residue number reindexed from 1)		H27 H75 D160 H164
Annotation score1
Enzymatic activity
Enzyme Commision number 1.15.1.1: superoxide dismutase.
Gene Ontology
Molecular Function
GO:0004784 superoxide dismutase activity
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
Biological Process
GO:0006801 superoxide metabolic process
GO:0019430 removal of superoxide radicals
Cellular Component
GO:0005739 mitochondrion

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6cys, PDBe:6cys, PDBj:6cys
PDBsum6cys
PubMed
UniProtG0RQS7

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