8TM2

Preclinical Characterization of Pan-NKG2D Ligand-Binding NKG2D Receptor Decoys

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	NKG2-D type II integral membrane protein	polymer	264	30432.4	1	UniProt (P26718) Pfam (PF00059)	Homo sapiens (human)	Killer cell lectin-like receptor subfamily K member 1,NK cell receptor D,NKG2-D-activating NK receptor
2	B (C)	MHC class I polypeptide-related sequence A	polymer	188	22218.0	1	UniProt (Q29983) Pfam (PF00129)	Homo sapiens (human)
3	C, D (D, B)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	2	In PDB GlyTouCan (G42666HT)
4	E, F, G, H (A, C)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	4	Chemie (NAG)
5	I (C)	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
6	J, K (A, C)	water	water		18.0	22	Chemie (HOH)

Sequence modifications

A: 3 - 135 (UniProt: P26718)

PDB	External Database	Details
Gly 1	-	expression tag
Ser 2	-	expression tag

A: 136 - 264 (UniProt: P26718)
C: 1 - 182 (UniProt: Q29983)

PDB	External Database	Details
Ala 68	Gly 91	conflict
Trp 69	Asn 92	conflict
Leu 125	Lys 148	conflict
Gln 152	Lys 175	conflict
Asp 154	Lys 177	conflict
Arg 158	His 181	conflict
Phe 166	Gln 189	conflict
His 183	-	expression tag
His 184	-	expression tag
His 185	-	expression tag
His 186	-	expression tag
His 187	-	expression tag
His 188	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	52650.4
Branched	Number of molecules	2
	Total formula weight	848.8
Non-Polymers*	Number of molecules	5
	Total formula weight	976.9
All*	Total formula weight	54476.1

*Water molecules are not included.