Structure of PDB 6x01 Chain A Binding Site BS01

Receptor Information
>6x01 Chain A (length=400) Species: 70601 (Pyrococcus horikoshii OT3) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VLQKILIGLILGAIVGLILGHYGYADAVKTYVKPFGDLFVRLLKMLVMPI
VFASLVVGAASISPARLGRVGVKIVVYYLLTSAFAVTLGIIMARLFNPGA
GIHLAVGGQQFPPLVKILLDIVPTNPFGALANGQVLPTIFFAIILGIAIT
YLMNSENEKVRKSAETLLDAINGLAEAMYKIVNGVMQYAPIGVFALIAYC
MAEQGVKVVGELAKVTAAVYVGLTLQILLVYFVLLKIYGIDPISFIKKAK
DAMLTAFVTRSSSGTLPVTMRVAKEMGISEGIYSFTLPLGATINMDGTAL
YQGVSTFFIANALGSHLTVGQQLTIVLTAVLASIGTAGVPGAGAIMLAMV
LESVGLPLTDPNVAAAYAMILGIDCILDMGRTMVNVTGDLTGTAIVAKTE
Ligand information
Ligand IDASP
InChIInChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
InChIKeyCKLJMWTZIZZHCS-REOHCLBHSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(C(C(=O)O)N)C(=O)O
OpenEye OEToolkits 1.7.0C([C@@H](C(=O)O)N)C(=O)O
CACTVS 3.370N[CH](CC(O)=O)C(O)=O
CACTVS 3.370N[C@@H](CC(O)=O)C(O)=O
ACDLabs 12.01O=C(O)CC(N)C(=O)O
FormulaC4 H7 N O4
NameASPARTIC ACID
ChEMBLCHEMBL274323
DrugBankDB00128
ZINCZINC000000895032
PDB chain6x01 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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PDB6x01 Glutamate transporters have a chloride channel with two hydrophobic gates.
Resolution3.65 Å
Binding residue
(original residue number in PDB)		R276 S277 S278 M311 G354 V355 A358 G359 D394 R397 T398
Binding residue
(residue number reindexed from 1)		R260 S261 S262 M295 G338 V339 A342 G343 D378 R381 T382
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005283 amino acid:sodium symporter activity
GO:0015108 chloride transmembrane transporter activity
GO:0015183 L-aspartate transmembrane transporter activity
GO:0015293 symporter activity
GO:0015501 glutamate:sodium symporter activity
GO:0042802 identical protein binding
GO:0046872 metal ion binding
Biological Process
GO:0006865 amino acid transport
GO:0035725 sodium ion transmembrane transport
GO:0046942 carboxylic acid transport
GO:0070207 protein homotrimerization
GO:0070778 L-aspartate transmembrane transport
GO:0140009 L-aspartate import across plasma membrane
GO:1902476 chloride 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:6x01, PDBe:6x01, PDBj:6x01
PDBsum6x01
PubMed33597752
UniProtO59010|GLT_PYRHO Glutamate transporter homolog (Gene Name=PH1295)

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