9D3C

Gly-,Glu-,(S)-(+)-ketamine bound GluN1a-2B-2D NMDAR

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, C (A, C)	Glutamate receptor ionotropic, NMDA 1	polymer	825	92691.8	2	UniProt (Q05586) Pfam (PF01094) Pfam (PF10613) Pfam (PF00060)	Homo sapiens (human)	GluN1,Glutamate [NMDA] receptor subunit zeta-1,N-methyl-D-aspartate receptor subunit NR1,NMD-R1
2	B (B)	Glutamate receptor ionotropic, NMDA 2B	polymer	884	98622.2	1	UniProt (Q13224) Pfam (PF01094) Pfam (PF10613) Pfam (PF00060)	Homo sapiens (human)	GluN2B,Glutamate [NMDA] receptor subunit epsilon-2,N-methyl D-aspartate receptor subtype 2B,NMDAR2B,NR2B,N-methyl-D-aspartate receptor subunit 3,NR3,hNR3
3	D (D)	Glutamate receptor ionotropic, NMDA 2D	polymer	861	94120.6	1	UniProt (O15399) Pfam (PF01094) Pfam (PF10613) Pfam (PF00060)	Homo sapiens (human)	GluN2D,EB11,Glutamate [NMDA] receptor subunit epsilon-4,N-methyl D-aspartate receptor subtype 2D,NMDAR2D,NR2D
4	E (E)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	1	In PDB GlyTouCan (G42666HT)
5	F, N (A, C)	GLYCINE	non-polymer		75.1	2	Chemie (GLY)
6	G, H, I, J, L... (A, B, C)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	8	Chemie (NAG)
7	K, R (B, D)	GLUTAMIC ACID	non-polymer		147.1	2	Chemie (GLU)
8	M (B)	(2~{S})-2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one	non-polymer		237.7	1	Chemie (JC9)

Sequence modifications

A, C: 23 - 847 (UniProt: Q05586)

PDB	External Database	Details
Asn 844	Arg 844	engineered mutation
Gly 845	Arg 845	engineered mutation
Ala 846	Lys 846	engineered mutation

B: 27 - 852 (UniProt: Q13224)

PDB	External Database	Details
Trp -8	-	expression tag
Ser -7	-	expression tag
His -6	-	expression tag
Pro -5	-	expression tag
Gln -4	-	expression tag
Phe -3	-	expression tag
Glu -2	-	expression tag
Lys -1	-	expression tag
Gly 0	-	expression tag
Gly 1	-	expression tag
Gly 2	-	expression tag
Ser 3	-	expression tag
Gly 4	-	expression tag
Gly 5	-	expression tag
Gly 6	-	expression tag
Ser 7	-	expression tag
Gly 8	-	expression tag
Gly 9	-	expression tag
Ser 10	-	expression tag
Ala 11	-	expression tag
Trp 12	-	expression tag
Ser 13	-	expression tag
His 14	-	expression tag
Pro 15	-	expression tag
Gln 16	-	expression tag
Phe 17	-	expression tag
Glu 18	-	expression tag
Lys 19	-	expression tag
Gly 20	-	expression tag
Ala 21	-	expression tag
Leu 22	-	expression tag
Val 23	-	expression tag
Pro 24	-	expression tag
Arg 25	-	expression tag
Gly 26	-	expression tag
Ser 588	Cys 588	engineered mutation
Ser 838	Cys 838	engineered mutation
Ser 849	Cys 849	engineered mutation
Gly 853	-	expression tag
Pro 854	-	expression tag
Gly 855	-	expression tag
Ser 856	-	expression tag
Gly 857	-	expression tag
Ala 858	-	expression tag
Thr 859	-	expression tag
Asn 860	-	expression tag
Phe 861	-	expression tag
Ser 862	-	expression tag
Leu 863	-	expression tag
Leu 864	-	expression tag
Lys 865	-	expression tag
Gln 866	-	expression tag
Ala 867	-	expression tag
Gly 868	-	expression tag
Asp 869	-	expression tag
Val 870	-	expression tag
Glu 871	-	expression tag
Glu 872	-	expression tag
Asn 873	-	expression tag
Pro 874	-	expression tag
Gly 875	-	expression tag

D: 28 - 880 (UniProt: O15399)

PDB	External Database	Details
Glu 881	-	expression tag
Thr 882	-	expression tag
Ser 883	-	expression tag
Gln 884	-	expression tag
Val 885	-	expression tag
Ala 886	-	expression tag
Pro 887	-	expression tag
Ala 888	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	378126.4
Branched	Number of molecules	1
	Total formula weight	424.4
Non-Polymers*	Number of molecules	13
	Total formula weight	2451.8
All*	Total formula weight	381002.6

*Water molecules are not included.