5I2N
Structure of the human GluN1/GluN2A LBD in complex with N-ethyl-7-{[2-fluoro-3-(trifluoromethyl)phenyl]methyl}-2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-3-carboxamide (compound 29)
Functional Information from GO Data
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 2 |
Details | binding site for residue CA A 301 |
Chain | Residue |
A | ASP259 |
B | HOH483 |
site_id | AC2 |
Number of Residues | 11 |
Details | binding site for residue GLU A 302 |
Chain | Residue |
A | TYR213 |
A | ASP214 |
A | HOH446 |
A | HOH493 |
A | HIS87 |
A | SER113 |
A | THR115 |
A | ARG120 |
A | GLY171 |
A | SER172 |
A | THR173 |
site_id | AC3 |
Number of Residues | 16 |
Details | binding site for residue 67J A 303 |
Chain | Residue |
A | VAL128 |
A | PRO129 |
A | PHE130 |
A | VAL131 |
A | GLU132 |
A | THR242 |
A | GLY243 |
A | LEU263 |
A | HOH403 |
A | HOH455 |
B | LYS140 |
B | PRO141 |
B | TYR144 |
B | LEU270 |
B | HIS273 |
B | HOH463 |
site_id | AC4 |
Number of Residues | 10 |
Details | binding site for residue EPE B 301 |
Chain | Residue |
B | SER4 |
B | THR5 |
B | ARG6 |
B | LEU7 |
B | LYS8 |
B | ASP120 |
B | PRO260 |
B | TRP261 |
B | HOH420 |
B | HOH457 |
site_id | AC5 |
Number of Residues | 9 |
Details | binding site for residue GLY B 302 |
Chain | Residue |
B | PHE93 |
B | PRO125 |
B | LEU126 |
B | THR127 |
B | ARG132 |
B | SER180 |
B | SER181 |
B | ASP225 |
B | PHE251 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 4 |
Details | BINDING: BINDING => ECO:0000269|PubMed:26875626, ECO:0000269|PubMed:26919761, ECO:0000269|PubMed:28105280, ECO:0007744|PDB:5H8F, ECO:0007744|PDB:5H8H, ECO:0007744|PDB:5H8N, ECO:0007744|PDB:5H8Q, ECO:0007744|PDB:5I2K, ECO:0007744|PDB:5I2N, ECO:0007744|PDB:5KCJ, ECO:0007744|PDB:5KDT, ECO:0007744|PDB:5TP9, ECO:0007744|PDB:5TPA |
Chain | Residue | Details |
B | LYS104 | |
B | MET111 | |
B | ILE160 | |
B | TYR204 |
site_id | SWS_FT_FI2 |
Number of Residues | 4 |
Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255 |
Chain | Residue | Details |
B | THR28 | |
B | THR59 | |
B | MET79 | |
B | GLY243 |
site_id | SWS_FT_FI3 |
Number of Residues | 3 |
Details | CARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255 |
Chain | Residue | Details |
A | ASN45 | |
A | ASN46 | |
A | ASN170 |