5I59

Glutamate- and glycine-bound GluN1/GluN2A agonist binding domains with MPX 007

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Glutamate receptor ionotropic, NMDA 1,Glutamate receptor ionotropic, NMDA 1	polymer	292	33340.0	1	UniProt (P35439) Pfam (PF10613) Pfam (PF00060) Pfam (PF00497) In PDB	Rattus norvegicus (Rat)	GluN1,Glutamate [NMDA] receptor subunit zeta-1,N-methyl-D-aspartate receptor subunit NR1,NMD-R1,GluN1,Glutamate [NMDA] receptor subunit zeta-1,N-methyl-D-aspartate receptor subunit NR1,NMD-R1
2	B	Glutamate receptor ionotropic, NMDA 2A,Glutamate receptor ionotropic, NMDA 2A	polymer	281	31533.1	1	UniProt (Q00959) Pfam (PF10613) Pfam (PF00060) Pfam (PF00497) In PDB	Rattus norvegicus (Rat)	GluN2A,Glutamate [NMDA] receptor subunit epsilon-1,N-methyl D-aspartate receptor subtype 2A,NR2A,GluN2A,Glutamate [NMDA] receptor subunit epsilon-1,N-methyl D-aspartate receptor subtype 2A,NR2A
3	A	GLYCINE	non-polymer		75.1	1	Chemie (GLY)
4	B	GLUTAMIC ACID	non-polymer		147.1	1	Chemie (GLU)
5	B	5-({[(3,4-difluorophenyl)sulfonyl]amino}methyl)-6-methyl-N-[(2-methyl-4H-1lambda~4~,3-thiazol-5-yl)methyl]pyrazine-2-carboxamide	non-polymer		455.5	1	Chemie (67Q)
6		water	water		18.0	163	Chemie (HOH)

Sequence modifications

A: 2 - 152 (UniProt: P35439)

PDB	External Database	Details
Gly 1	-	expression tag

A: 155 - 292 (UniProt: P35439)

PDB	External Database	Details
Gly 153	-	linker
Thr 154	-	linker

B: 5 - 142 (UniProt: Q00959)

PDB	External Database	Details
Ser 4	-	expression tag

B: 145 - 284 (UniProt: Q00959)

PDB	External Database	Details
Gly 143	-	linker
Thr 144	-	linker
Thr 242	Ser 758	see remark 999

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	64873.1
Non-Polymers*	Number of molecules	3
	Total formula weight	677.7
All*	Total formula weight	65550.8

*Water molecules are not included.