Structure of PDB 9b1n Chain A Binding Site BS01

Receptor Information
>9b1n Chain A (length=515) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FSELLDLVGGLGRFQVLQTMALMVSIMWLCTQSMLENFSAAVPSHRCWAP
LLDNSTAVSTSLSPEALLAISIPPGPNQRPHQCRRFRQPQWQLLDPNATA
TSWSEADTEPCVDGWVYDRSIFTSTIVAKWNLVCDSHALKPMAQSIYLAG
ILVGAAACGPASDRFGRRLVLTWSYLQMAVMGTAAAFAPAFPVYCLFRFL
LAFAVAGVMMNTGTLLMEWTAARARPLVMTLNSLGFSFGHGLTAAVAYGV
RDWTLLQLVVSVPFFLCFLYSWWLPESARWLIIKGKPDQALQELRKVARI
NGHKEAKNLTIEVLMSSVKEEVASAKEPRSVLDLFCVPGLRFRTCISTLC
WFAFGFTFFGLALDLQALGSNIFLLQMFIGVVDIPAKMGALLLLSHLGRR
PTLAASLLLAGLCILANTLVPHEMGALRSALAVLGLGGVGAAFTCITIYS
SELFPTVLRMTAVGLGQMAARGGAILGPLVRLLGVHGPWLPLLVYGTVPV
LSGLAALLLPETQSL
Ligand information
Ligand IDVGL
InChIInChI=1S/C5H4N2O2/c8-5(9)4-3-6-1-2-7-4/h1-3H,(H,8,9)
InChIKeyNIPZZXUFJPQHNH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)c1nccnc1
OpenEye OEToolkits 1.6.1c1cnc(cn1)C(=O)O
CACTVS 3.352OC(=O)c1cnccn1
FormulaC5 H4 N2 O2
NamePYRAZINE-2-CARBOXYLIC ACID;
PYRAZINOIC ACID
ChEMBLCHEMBL613
DrugBank
ZINCZINC000001081066
PDB chain9b1n Chain A Residue 602 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB9b1n Transport mechanism and structural pharmacology of human urate transporter URAT1.
Resolution3.1 Å
Binding residue
(original residue number in PDB)		F238 K389 F445
Binding residue
(residue number reindexed from 1)		F236 K387 F443
Annotation score2
External links
PDB RCSB:9b1n, PDBe:9b1n, PDBj:9b1n
PDBsum9b1n
PubMed39245778
UniProtQ96S37|S22AC_HUMAN Solute carrier family 22 member 12 (Gene Name=SLC22A12)

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