9L80

Structure of GPR119-Gs complex bound to an allosteric modulator

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Guanine nucleotide-binding protein G(s) subunit alpha isoforms short	polymer	245	28299.1	1	UniProt (P63092) Pfam (PF00503)	Homo sapiens (human)	Adenylate cyclase-stimulating G alpha protein
2	B (B)	Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1	polymer	351	38744.4	1	UniProt (P54311) Pfam (PF25391)	Rattus norvegicus (Norway rat)	Transducin beta chain 1
3	C (G)	Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2	polymer	68	7563.8	1	UniProt (P63212) Pfam (PF00631)	Bos taurus (domestic cattle)	G gamma-I
4	D (N)	NB35	polymer	138	15140.7	1		Lama glama
5	E (R)	Glucose-dependent insulinotropic receptor	polymer	359	39675.8	1	UniProt (Q8TDV5) Pfam (PF00001)	Homo sapiens (human)	G-protein coupled receptor 119
6	F (S)	scFv16	polymer	259	27784.9	1		Mus musculus
7	G (R)	(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOIC ACID DIMETHYL ESTER	non-polymer		704.9	1	Chemie (DR7) PubChem (21696352) PubChem (22940470) PubChem (44182297) PubChem (22940469) PubChem (148192) PubChem (66587081) PubChem (71313511) PubChem (53667683) PubChem (56971648) PubChem (59651325) PubChem (60098916) PubChem (71306984) PubChem (90944682) PubChem (92402749) PubChem (93971971) PubChem (93971973) PubChem (6101863) PubChem (6540550) PubChem (6540690) PubChem (9962872) PubChem (93971972) PubChem (131839569) PubChem (99650408) PubChem (134694218) PubChem (124636677) PubChem (138393803) PubChem (138393804) PubChem (144108234) PubChem (144517104) PubChem (173493799)

Sequence modifications

A: 204 - 384 (UniProt: P63092)

PDB	External Database	Details
Gly 9	-	expression tag
Cys 10	-	expression tag
Thr 11	-	expression tag
Leu 12	-	expression tag
Ser 13	-	expression tag
Ala 14	-	expression tag
Glu 15	-	expression tag
Asp 16	-	expression tag
Lys 17	-	expression tag
Ala 18	-	expression tag
Ala 19	-	expression tag
Val 20	-	expression tag
Glu 21	-	expression tag
Arg 22	-	expression tag
Ser 23	-	expression tag
Lys 24	-	expression tag
Met 25	-	expression tag
Ile 26	-	expression tag
Glu 27	-	expression tag
Lys 28	-	expression tag
Gln 29	-	expression tag
Leu 30	-	expression tag
Gln 31	-	expression tag
Lys 32	-	expression tag
Asp 33	-	expression tag
Lys 34	-	expression tag
Gln 35	-	expression tag
Val 36	-	expression tag
Tyr 37	-	expression tag
Arg 38	-	expression tag
Ala 39	-	expression tag
Thr 40	-	expression tag
His 41	-	expression tag
Arg 42	-	expression tag
Leu 43	-	expression tag
Leu 44	-	expression tag
Leu 45	-	expression tag
Leu 46	-	expression tag
Gly 47	-	expression tag
Ala 48	-	expression tag
Asp 49	-	expression tag
Asn 50	-	expression tag
Ser 51	-	expression tag
Gly 52	-	expression tag
Lys 53	-	expression tag
Ser 54	-	expression tag
Thr 55	-	expression tag
Ile 56	-	expression tag
Val 57	-	expression tag
Lys 189	-	expression tag
Gln 190	-	expression tag
Met 191	-	expression tag
Arg 192	-	expression tag
Ile 193	-	expression tag
Leu 194	-	expression tag
His 195	-	expression tag
Gly 196	-	expression tag
Gly 197	-	expression tag
Ser 198	-	expression tag
Gly 199	-	expression tag
Gly 200	-	expression tag
Ser 201	-	expression tag
Gly 202	-	expression tag
Gly 203	-	expression tag
Asp 249	Ala 249	engineered mutation
Asp 252	Ser 252	engineered mutation
-	Met 255	deletion
-	Val 256	deletion
-	Ile 257	deletion
-	Arg 258	deletion
-	Glu 259	deletion
-	Asp 260	deletion
-	Asn 261	deletion
-	Gln 262	deletion
-	Thr 263	deletion
-	Asn 264	deletion
Asp 262	Leu 272	engineered mutation
Ala 362	Ile 372	engineered mutation
Ile 365	Val 375	engineered mutation

B: 2 - 340 (UniProt: P54311)

PDB	External Database	Details
Met -10	-	initiating methionine
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
Gly -3	-	expression tag
Ser -2	-	expression tag
Leu -1	-	expression tag
Leu 0	-	expression tag
Gln 1	-	expression tag

R: 1 - 335 (UniProt: Q8TDV5)

PDB	External Database	Details
Met -23	-	initiating methionine
Lys -22	-	expression tag
Thr -21	-	expression tag
Ile -20	-	expression tag
Ile -19	-	expression tag
Ala -18	-	expression tag
Leu -17	-	expression tag
Ser -16	-	expression tag
Tyr -15	-	expression tag
Ile -14	-	expression tag
Phe -13	-	expression tag
Cys -12	-	expression tag
Leu -11	-	expression tag
Val -10	-	expression tag
Phe -9	-	expression tag
Ala -8	-	expression tag
Asp -7	-	expression tag
Tyr -6	-	expression tag
Lys -5	-	expression tag
Asp -4	-	expression tag
Asp -3	-	expression tag
Asp -2	-	expression tag
Asp -1	-	expression tag
Ala 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	157208.7
Non-Polymers*	Number of molecules	1
	Total formula weight	704.9
All*	Total formula weight	157913.5

*Water molecules are not included.