Structure of PDB 6hto Chain B Binding Site BS01

Receptor Information
>6hto Chain B (length=379) 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
LVADLRRPRHILGRIEASGTPVDHFVNPA
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 chain6hto Chain B Residue 501 [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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PDB6hto Radical S-Adenosyl-l-methionine Tryptophan Lyase (NosL): How the Protein Controls the Carboxyl Radical •CO2-Migration.
Resolution1.45 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:6hto, PDBe:6hto, PDBj:6hto
PDBsum6hto
PubMed30418774
UniProtC6FX51

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