Structure of PDB 4jh8 Chain A Binding Site BS03
Receptor Information
>4jh8 Chain A (length=138) Species:
222523
(Bacillus cereus ATCC 10987) [
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MLNGINHLCFSVSNLEDSIEFYEKVLEGELLVRGRKLAYFNICGVWVALN
EEIHIPRNEIYQSYTHIAFSVEQKDFESLLQRLEENDVHILKGRERDVRD
CESIYFVDPDGHKFEFHSGTLQDRLNYYREDKPHMTFY
Ligand information
Ligand ID
CYS
InChI
InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1
InChIKey
XUJNEKJLAYXESH-REOHCLBHSA-N
SMILES
Software
SMILES
CACTVS 3.341
N[CH](CS)C(O)=O
OpenEye OEToolkits 1.5.0
C([C@@H](C(=O)O)N)S
CACTVS 3.341
N[C@@H](CS)C(O)=O
ACDLabs 10.04
O=C(O)C(N)CS
OpenEye OEToolkits 1.5.0
C(C(C(=O)O)N)S
Formula
C3 H7 N O2 S
Name
CYSTEINE
ChEMBL
CHEMBL863
DrugBank
DB00151
ZINC
ZINC000000895042
PDB chain
4jh8 Chain A Residue 206 [
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Receptor-Ligand Complex Structure
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PDB
4jh8
Structural and Chemical Aspects of Resistance to the Antibiotic Fosfomycin Conferred by FosB from Bacillus cereus.
Resolution
1.41 Å
Binding residue
(original residue number in PDB)
C101 S118
Binding residue
(residue number reindexed from 1)
C101 S118
Annotation score
4
Enzymatic activity
Enzyme Commision number
2.5.1.-
Gene Ontology
Molecular Function
GO:0000287
magnesium ion binding
GO:0016740
transferase activity
GO:0016765
transferase activity, transferring alkyl or aryl (other than methyl) groups
GO:0046872
metal ion binding
Biological Process
GO:0046677
response to antibiotic
Cellular Component
GO:0005737
cytoplasm
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:4jh8
,
PDBe:4jh8
,
PDBj:4jh8
PDBsum
4jh8
PubMed
24004181
UniProt
Q739M9
|FOSB_BACC1 Metallothiol transferase FosB (Gene Name=fosB)
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