Structure of PDB 4uq8 Chain F Binding Site BS01
Receptor Information
>4uq8 Chain F (length=411) Species:
9913
(Bos taurus) [
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AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAAAAAACAACAACAAAAAAAAAAAAAAA
AAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAA
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
4uq8 Chain F Residue 508 [
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Receptor-Ligand Complex Structure
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PDB
4uq8
Architecture of Mammalian Respiratory Complex I.
Resolution
4.95 Å
Binding residue
(original residue number in PDB)
C359 X360 X361 C362 C365 X404 C405 X408
Binding residue
(residue number reindexed from 1)
C329 X330 X331 C332 C335 X374 C375 X378
Annotation score
4
External links
PDB
RCSB:4uq8
,
PDBe:4uq8
,
PDBj:4uq8
PDBsum
4uq8
PubMed
25209663
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