Structure of PDB 4qym Chain B Binding Site BS01
Receptor Information
>4qym Chain B (length=364) Species:
240292
(Trichormus variabilis ATCC 29413) [
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NTIPIGIALAQTSNVALLGQEQVAGAKIAEKYFNDKGGVNGTPIKLIFQD
TAGDEAGTINAFQTLINKDKVVGIVGPTLSQQAFSANPIAERAKVPVVGP
SNTAKGIPEIGDYVARVSAPVSVVAPNSVKAALKQNPNIKKVAVFFAQND
AFSKSETEIFQQTVKDQGLELVTVQKFQTTDTDFQSQATNAINLKPDLVI
ISGLAADGGNLVRQLRELGYQGAIIGGDGLNTSNVFAVCKALCDGVLIAQ
AYSPEYTGEINKAFRQAYVDQYKKEPPQFSAQAFAAVQVYVESLKALDTK
NKVSKIQLPELRTELNKQLLTGKYNTPLGEISFTPIGEVVQKDFYVAQIK
MEKDGSQGKFTFLK
Ligand information
Ligand ID
MET
InChI
InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
InChIKey
FFEARJCKVFRZRR-BYPYZUCNSA-N
SMILES
Software
SMILES
CACTVS 3.341
CSCC[CH](N)C(O)=O
OpenEye OEToolkits 1.5.0
CSCCC(C(=O)O)N
CACTVS 3.341
CSCC[C@H](N)C(O)=O
OpenEye OEToolkits 1.5.0
CSCC[C@@H](C(=O)O)N
ACDLabs 10.04
O=C(O)C(N)CCSC
Formula
C5 H11 N O2 S
Name
METHIONINE
ChEMBL
CHEMBL42336
DrugBank
DB00134
ZINC
ZINC000001532529
PDB chain
4qym Chain B Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
4qym
The crystal structure of a solute-binding protein (N280D mutant) from Anabaena variabilis ATCC 29413 in complex with methionine
Resolution
1.581 Å
Binding residue
(original residue number in PDB)
L70 Q74 T130 L131 S132 S153 N154 T155 F204 F331
Binding residue
(residue number reindexed from 1)
L18 Q22 T78 L79 S80 S101 N102 T103 F152 F279
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0046872
metal ion binding
View graph for
Molecular Function
External links
PDB
RCSB:4qym
,
PDBe:4qym
,
PDBj:4qym
PDBsum
4qym
PubMed
UniProt
Q3MFZ5
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