Structure of PDB 6f2w Chain A Binding Site BS01

Receptor Information
>6f2w Chain A (length=433) Species: 333990 (Carnobacterium sp. AT7) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKEVSGITALTVVVGTVIGAGIFFKPTAVYGAAGAPGLGLLAWFVAGIIT
IAGGLTVAEIGTIYPQTGGMMIYLEKVYGRWLGFLVGWAQMVIYYPANIA
ALAIIFATQFVNLFALSDSTIVPTAILTSIFLMGVNFLGTKYSGWIQTLA
TILKLIPLVVIIVAGLLYPGGGVIRLVPFSVETHPVLTSFGSALIATLFA
YDGWINVGTLAGEMKNPGKMLPKVIIGGLSIVMAVYLLTNIAYLFVLDSS
QLAGTDTPAALVASHLFEGIGSKLVTIGILISVFGGINGYIISGLRVPYA
LATQKMLPFSDWFARINPKTNLPINGGLVMLGIAIVMILTGQFNQLTDLI
VFVIWFFITLTFIAVIILRKTQPDIERPYRVPFYPVIPLIAIIGGLYIIF
NTLIVQPKNAFIGILLTLIGIPIYFYCKKKYGS
Ligand information
Ligand IDAIB
InChIInChI=1S/C4H9NO2/c1-4(2,5)3(6)7/h5H2,1-2H3,(H,6,7)
InChIKeyFUOOLUPWFVMBKG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)C(N)(C)C
OpenEye OEToolkits 1.5.0CC(C)(C(=O)O)N
CACTVS 3.341CC(C)(N)C(O)=O
FormulaC4 H9 N O2
NameALPHA-AMINOISOBUTYRIC ACID
ChEMBLCHEMBL1230906
DrugBankDB02952
ZINCZINC000000901801
PDB chain6f2w Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6f2w L amino acid transporter structure and molecular bases for the asymmetry of substrate interaction.
Resolution3.4 Å
Binding residue
(original residue number in PDB)		V17 G19 A20 G21 F199 A200 D202
Binding residue
(residue number reindexed from 1)		V17 G19 A20 G21 F199 A200 D202
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0015179 L-amino acid transmembrane transporter activity
GO:0022857 transmembrane transporter activity
Biological Process
GO:0003333 amino acid transmembrane transport
GO:0055085 transmembrane transport
GO:1902475 L-alpha-amino acid transmembrane transport
Cellular Component
GO:0005886 plasma membrane
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6f2w, PDBe:6f2w, PDBj:6f2w
PDBsum6f2w
PubMed31000719
UniProtA8UCQ5

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