Structure of PDB 5tpw Chain B Binding Site BS01

Receptor Information
>5tpw Chain B (length=331) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LNIAVLLGHSHDVTEDVNVVALLMNRTDPKSLITHVCDLMSGARIHGLVF
GDDTDQEAVAQMLDFISSQTFIPILGIHGGASMIMADKDPTSTFFQFGAS
IQQQATVMLKIMQDYDWHVFSLVTTIFPGYRDFISFIKTTVDNSFVGWDM
QNVITLDTSFEDAKTQVQLKKIHSSVILLYCSKDEAVLILSEARSLGLTG
YDFFWIVPSLVSGNTELIPKEFPSGLISVSYDDWDYSLEARVRDGLGILT
TAASSMLEKFSYIPEAKASCYGTPLHTLHQFMVNVTWDGKDLSFTEEGYQ
VHPRLVVIVLNKDREWEKVGKWENQTLSLRH
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5tpw Chain B Residue 401 [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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PDB5tpw Molecular Basis for Subtype Specificity and High-Affinity Zinc Inhibition in the GluN1-GluN2A NMDA Receptor Amino-Terminal Domain.
Resolution2.909 Å
Binding residue
(original residue number in PDB)		H44 H128 E266 D282
Binding residue
(residue number reindexed from 1)		H11 H78 E216 D232
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5tpw, PDBe:5tpw, PDBj:5tpw
PDBsum5tpw
PubMed27916457
UniProtQ00959|NMDE1_RAT Glutamate receptor ionotropic, NMDA 2A (Gene Name=Grin2a)

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