Structure of PDB 5luf Chain I Binding Site BS01
Receptor Information
>5luf Chain I (length=162) Species:
9913
(Bos taurus) [
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AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAACAACAACAAACAAAAAAAAAAAAAAAAAAAAAAAAAAA
ACAACAACAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
AAAAAAAAAAAA
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
5luf Chain I Residue 201 [
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Receptor-Ligand Complex Structure
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PDB
5luf
Functional asymmetry and electron flow in the bovine respirasome.
Resolution
9.1 Å
Binding residue
(original residue number in PDB)
C87 C116 X117 X118 C119 X120 X121 C122
Binding residue
(residue number reindexed from 1)
C73 C102 X103 X104 C105 X106 X107 C108
Annotation score
4
External links
PDB
RCSB:5luf
,
PDBe:5luf
,
PDBj:5luf
PDBsum
5luf
PubMed
27830641
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