Structure of PDB 5h8h Chain B Binding Site BS01
Receptor Information
>5h8h Chain B (length=282) Species:
9606
(Homo sapiens) [
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MSTRLKIVTIHQEPFVYVKPTLSDGTCKEEFTVNGDPVKKVICTGPNDTS
PGSPRHTVPQCCYGFCIDLLIKLARTMNFTYEVHLVADGKFGTQERVNKK
EWNGMMGELLSGQADMIVAPLTINNERAQYIEFSKPFKYQGLTILVKKGT
RITGINDPRLRNPSDKFIYATVKQSSVDIYFRRQVELSTMYRHMEKHNYE
SAAEAIQAVRDNKLHAFIWDSAVLEFEASQKCDLVTTGELFFRSGFGIGM
RKDSPWKQNVSLSILKSHENGFMEDLDKTWVR
Ligand information
Ligand ID
GLY
InChI
InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)
InChIKey
DHMQDGOQFOQNFH-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C(C(=O)O)N
CACTVS 3.341
NCC(O)=O
ACDLabs 10.04
O=C(O)CN
Formula
C2 H5 N O2
Name
GLYCINE
ChEMBL
CHEMBL773
DrugBank
DB00145
ZINC
ZINC000004658552
PDB chain
5h8h Chain B Residue 302 [
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Receptor-Ligand Complex Structure
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PDB
5h8h
Positive Allosteric Modulators of GluN2A-Containing NMDARs with Distinct Modes of Action and Impacts on Circuit Function.
Resolution
2.23 Å
Binding residue
(original residue number in PDB)
F93 T127 R132 S180 S181 D225
Binding residue
(residue number reindexed from 1)
F91 T122 R127 S175 S176 D220
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0015276
ligand-gated monoatomic ion channel activity
Cellular Component
GO:0016020
membrane
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Molecular Function
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Cellular Component
External links
PDB
RCSB:5h8h
,
PDBe:5h8h
,
PDBj:5h8h
PDBsum
5h8h
PubMed
26875626
UniProt
Q05586
|NMDZ1_HUMAN Glutamate receptor ionotropic, NMDA 1 (Gene Name=GRIN1)
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