Structure of PDB 4ooa Chain D Binding Site BS01
Receptor Information
>4ooa Chain D (length=64) Species:
9606
(Homo sapiens) [
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SLINLKIQKENPKVVNEINIEDLSLTKAAYCRCWRSKTFPACDGSCNKHN
ELTGDNVGPLILKK
Ligand information
Ligand ID
FES
InChI
InChI=1S/2Fe.2S
InChIKey
NIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0
S1[Fe]S[Fe]1
Formula
Fe2 S2
Name
FE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain
4ooa Chain D Residue 200 [
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Receptor-Ligand Complex Structure
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PDB
4ooa
A point mutation in the [2Fe-2S] cluster binding region of the NAF-1 protein (H114C) dramatically hinders the cluster donor properties.
Resolution
1.58 Å
Binding residue
(original residue number in PDB)
C99 R100 C101 C110 D111 G112 S113 C114 P127
Binding residue
(residue number reindexed from 1)
C31 R32 C33 C42 D43 G44 S45 C46 P59
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0051537
2 iron, 2 sulfur cluster binding
Biological Process
GO:0010506
regulation of autophagy
Cellular Component
GO:0043231
intracellular membrane-bounded organelle
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Molecular Function
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Cellular Component
External links
PDB
RCSB:4ooa
,
PDBe:4ooa
,
PDBj:4ooa
PDBsum
4ooa
PubMed
24914968
UniProt
Q8N5K1
|CISD2_HUMAN CDGSH iron-sulfur domain-containing protein 2 (Gene Name=CISD2)
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