Structure of PDB 4ysl Chain A Binding Site BS01

Receptor Information
>4ysl Chain A (length=294) Species: 351746 (Pseudomonas putida F1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MIIGNNLHVDAFYDEATSTISYLVMDRETRQCALIDSVLDYDPKSGRTCS
ASADRLVERVNELNASVRWVLETHVHADHLSAAAYLKEKLGGHTAIGAHI
TQVQKVFGALFNAEPGFARDGSQFDVLLEDEEGFRIGNLQARALHTPGHT
PACMSFMIEDAGEIAVFVGDTLFMPDYGTARCDFPGADARTLYRSIRRLL
AFPDQTRLFMCHDYLPGGRDMQYVTTVAEQRASNIHIHQGIDEDSFVAMR
EARDKTLEMPVLILPSVQVNMRSGQLPPPEANGVSYLKIPLNKL
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain4ysl Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4ysl Characterizations of Two Bacterial Persulfide Dioxygenases of the Metallo-beta-lactamase Superfamily.
Resolution1.4618 Å
Binding residue
(original residue number in PDB)		H74 H149 D170
Binding residue
(residue number reindexed from 1)		H74 H149 D170
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0046872 metal ion binding
GO:0050313 sulfur dioxygenase activity
Biological Process
GO:0006749 glutathione metabolic process
GO:0070813 hydrogen sulfide metabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:4ysl, PDBe:4ysl, PDBj:4ysl
PDBsum4ysl
PubMed26082492
UniProtA5VWI3

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