Structure of PDB 7yyl Chain H Binding Site BS01

Receptor Information
>7yyl Chain H (length=241) Species: 246194 (Carboxydothermus hydrogenoformans Z-2901) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AGLDLGSTNSKLVIIKEDGSYTFKVVPTRYEPVKAGELLLKNTGEIRNLV
VTGYGRVAFNRGKVVTEITCQARGCHELFPEVDYILDLGGQDAKIIKKDG
QGRVVNFLMNDKCAAGTGRFLEIILTAIGDDYRDEDLINEENAVPINSMC
TVFAESEVISLLARGTSKRAVIAGLFKTTAKRLAKFAESLGKPRKLIFTG
GGAKYPALRLFLQKEMGVEVVVPPEPSVTAALGAALIARET
Ligand information
Ligand IDSF4
InChIInChI=1S/4Fe.4S
InChIKeyLJBDFODJNLIPKO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
CACTVS 3.385S1[Fe]S[Fe]1.S2[Fe]S[Fe]2
FormulaFe4 S4
NameIRON/SULFUR CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain7yyl Chain G Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7yyl Structural basis for coupled ATP-driven electron transfer in the double-cubane cluster protein.
Resolution3.25 Å
Binding residue
(original residue number in PDB)		C115 M151 C152 F155
Binding residue
(residue number reindexed from 1)		C113 M149 C150 F153
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding

View graph for
Molecular Function
External links
PDB RCSB:7yyl, PDBe:7yyl, PDBj:7yyl
PDBsum7yyl
PubMed35905315
UniProtQ3AET8

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