Structure of PDB 5tq2 Chain B Binding Site BS01
Receptor Information
>5tq2 Chain B (length=335) Species:
10116
(Rattus norvegicus) [
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LNIAVLLGHSHDVTEREVNVVALLMNRTDPKSLITHVCDLMSGARIHGLV
FGDDTDQEAVAQMLDFISSQTFIPILGIHGGASMIMADKDPTSTFFQFGA
SIQQQATVMLKIMQDYDWHVFSLVTTIFPGYRDFISFIKTTVDNSFVGWD
MQNVITLDTSFEDAKTQVQLKKIHSSVILLYCSKDEAVLILSEARSLGLT
GYDFFWIVPSLVSGNTELIPKEFPSGLISVSYDDWDYSLEARVRDGLGIL
TTAASSMLEKFSYIPEAKASCYGQPLHTLHQFMVNVTWDGKDLSFTEEGY
QVHPRLVVIVLNKDREWEKVGKWENQTLSLRHAVW
Ligand information
Ligand ID
ZN
InChI
InChI=1S/Zn/q+2
InChIKey
PTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
Formula
Zn
Name
ZINC ION
ChEMBL
CHEMBL1236970
DrugBank
DB14532
ZINC
PDB chain
5tq2 Chain B Residue 401 [
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Receptor-Ligand Complex Structure
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PDB
5tq2
Molecular Basis for Subtype Specificity and High-Affinity Zinc Inhibition in the GluN1-GluN2A NMDA Receptor Amino-Terminal Domain.
Resolution
3.289 Å
Binding residue
(original residue number in PDB)
H44 H128 E266 D282
Binding residue
(residue number reindexed from 1)
H11 H79 E217 D233
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:5tq2
,
PDBe:5tq2
,
PDBj:5tq2
PDBsum
5tq2
PubMed
27916457
UniProt
Q00959
|NMDE1_RAT Glutamate receptor ionotropic, NMDA 2A (Gene Name=Grin2a)
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