Structure of PDB 8ibe Chain I Binding Site BS02
Receptor Information
>8ibe Chain I (length=172) Species:
10090
(Mus musculus) [
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TYKYVNKVDMKSATDNAARILMWTELIRGLGMTLSYLFREPATINYPFEK
GPLSPRFRGEHALRRYPSGEERCIACKLCEAICPAQAITIEAEPRADGSR
RTTRYDIDMTKCIYCGFCQEACPVDAIVEGPNFEFSTETHEELLYNKEKL
LNNGDKWEAEIAANIQADYLYR
Ligand information
Ligand ID
SF4
InChI
InChI=1S/4Fe.4S
InChIKey
LJBDFODJNLIPKO-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 2.0.7
[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
CACTVS 3.385
S1[Fe]S[Fe]1.S2[Fe]S[Fe]2
Formula
Fe4 S4
Name
IRON/SULFUR CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain
8ibe Chain I Residue 303 [
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Receptor-Ligand Complex Structure
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PDB
8ibe
Respiratory complex Peripheral Arm of CI, focus-refined map of type II, Wild type mouse under cold temperature
Resolution
3.3 Å
Binding residue
(original residue number in PDB)
C113 I114 A115 C116 C119 C162 I167
Binding residue
(residue number reindexed from 1)
C73 I74 A75 C76 C79 C122 I127
Annotation score
1
External links
PDB
RCSB:8ibe
,
PDBe:8ibe
,
PDBj:8ibe
PDBsum
8ibe
PubMed
UniProt
Q8K3J1
|NDUS8_MOUSE NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial (Gene Name=Ndufs8)
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