Structure of PDB 6htm Chain A Binding Site BS02

Receptor Information
>6htm Chain A (length=384) Species: 1885 (Streptomyces actuosus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GDFVLPELEDVRAEAATVDTRAVLALAEGEEPAESRAAVALALWEDRSIG
TAELQAAAEARCGARRPRLHTFVPLYTTNYCDSECKMCSMRKGNHRLDRK
FSGRKEITEQLEILYHHEGVRGVGFLTGEYEDKHTRLASAFRIGWAIRTA
LDLGFERVYFNIGSMEQDEIDVLGEWIGREDPVTMCVFQESYDRETYRRF
MGKTSVGVPKADFDRRVVSFDRWLDAGYRYVNPGVLVGLHDDLSAELVSL
VAHGDHLRSRGATADLSVPRMRPAMKSRDTTRVGDDDYLRLMSVVAFTCP
EQRLVLTTREPQEFQDVALGLAGVISPGSPDVAPYRAGCEARNDEKSSQF
LVADLRRPRHILGRIEASGTPVDHFVNPAGEASR
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 chain6htm Chain A Residue 2502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6htm Radical S-Adenosyl-l-methionine Tryptophan Lyase (NosL): How the Protein Controls the Carboxyl Radical •CO2-Migration.
Resolution1.7 Å
Binding residue
(original residue number in PDB)		C95 C99 C102 M104 R105 K224 Q363
Binding residue
(residue number reindexed from 1)		C81 C85 C88 M90 R91 K210 Q349
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding

View graph for
Molecular Function
External links
PDB RCSB:6htm, PDBe:6htm, PDBj:6htm
PDBsum6htm
PubMed30418774
UniProtC6FX51

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