8FE1

Alpha1/BetaB Heteromeric Glycine Receptor in 1 mM Glycine 20 uM Ivermectin State

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, D, C, B	Glycine receptor subunit alphaZ1	polymer	458	52537.6	4	UniProt (O93430) Pfam (PF02931) Pfam (PF02932) In PDB	Danio rerio (zebrafish)
2	E	Glycine receptor beta subunit 2	polymer	591	65820.3	1	UniProt (Q6DC22) Pfam (PF02931) Pfam (PF02932) In PDB	Danio rerio (zebrafish)	Glycine receptor,beta b,glycine receptor subunit beta precursor
3	C, A, D	GLYCINE	non-polymer		75.1	5	Chemie (GLY)
4	E, C, A, B, D	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	6	Chemie (NAG)
5	C, A, B, D	(2aE,4E,5'S,6S,6'R,7S,8E,11R,13R,15S,17aR,20R,20aR,20bS)-6'-[(2S)-butan-2-yl]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17 -oxo-3',4',5',6,6',10,11,14,15,17,17a,20,20a,20b-tetradecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacy clooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-4-O-(2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranosyl)-3-O-methyl-alpha-L-arabino-hexopyranoside	non-polymer		875.1	5	Chemie (IVM)
6	C, A, B, D, E	1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHOCHOLINE	non-polymer		678.9	8	Chemie (PX4)
7	D, E, C, A, B	PALMITIC ACID	non-polymer		256.4	28	Chemie (PLM)
8	C	DECANE	non-polymer		142.3	1	Chemie (D10)

Sequence modifications

A, D, C, B: 1 - 444 (UniProt: O93430)

PDB	External Database	Details
Leu 445	-	expression tag
Val 446	-	expression tag
Pro 447	-	expression tag
Arg 448	-	expression tag
Gly 449	-	expression tag
Ser 450	-	expression tag
His 451	-	expression tag
His 452	-	expression tag
His 453	-	expression tag
His 454	-	expression tag
His 455	-	expression tag
His 456	-	expression tag
His 457	-	expression tag
His 458	-	expression tag

E: 24 - 494 (UniProt: Q6DC22)

PDB	External Database	Details
Met -80	-	initiating methionine
Lys -79	-	expression tag
Ala -78	-	expression tag
Leu -77	-	expression tag
Lys -76	-	expression tag
Val -75	-	expression tag
Ile -74	-	expression tag
Phe -73	-	expression tag
Met -72	-	expression tag
Leu -71	-	expression tag
Leu -70	-	expression tag
Ile -69	-	expression tag
Ile -68	-	expression tag
Cys -67	-	expression tag
Leu -66	-	expression tag
Trp -65	-	expression tag
Met -64	-	expression tag
Glu -63	-	expression tag
Gly -62	-	expression tag
Gly -61	-	expression tag
Phe -60	-	expression tag
Thr -59	-	expression tag
Lys -58	-	expression tag
Glu -57	-	expression tag
Lys -56	-	expression tag
Ser -55	-	expression tag
Ala -54	-	expression tag
Lys -53	-	expression tag
Lys -52	-	expression tag
Trp -51	-	expression tag
Ser -50	-	expression tag
His -49	-	expression tag
Pro -48	-	expression tag
Gln -47	-	expression tag
Phe -46	-	expression tag
Glu -45	-	expression tag
Lys -44	-	expression tag
Gly -43	-	expression tag
Gly -42	-	expression tag
Gly -41	-	expression tag
Ser -40	-	expression tag
Gly -39	-	expression tag
Gly -38	-	expression tag
Gly -37	-	expression tag
Ser -36	-	expression tag
Gly -35	-	expression tag
Gly -34	-	expression tag
Gly -33	-	expression tag
Ser -32	-	expression tag
Trp -31	-	expression tag
Ser -30	-	expression tag
His -29	-	expression tag
Pro -28	-	expression tag
Gln -27	-	expression tag
Phe -26	-	expression tag
Glu -25	-	expression tag
Lys -24	-	expression tag
Gly -23	-	expression tag
Gly -22	-	expression tag
Gly -21	-	expression tag
Ser -20	-	expression tag
Gly -19	-	expression tag
Gly -18	-	expression tag
Gly -17	-	expression tag
Ser -16	-	expression tag
Gly -15	-	expression tag
Gly -14	-	expression tag
Gly -13	-	expression tag
Ser -12	-	expression tag
Trp -11	-	expression tag
Ser -10	-	expression tag
His -9	-	expression tag
Pro -8	-	expression tag
Gln -7	-	expression tag
Phe -6	-	expression tag
Glu -5	-	expression tag
Lys -4	-	expression tag
Gly -3	-	expression tag
Gly -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag
Gly 1	-	expression tag
Gly 2	-	expression tag
Gly 3	-	expression tag
Ser 4	-	expression tag
Gly 5	-	expression tag
Gly 6	-	expression tag
Gly 7	-	expression tag
Ser 8	-	expression tag
Trp 9	-	expression tag
Ser 10	-	expression tag
His 11	-	expression tag
Pro 12	-	expression tag
Gln 13	-	expression tag
Phe 14	-	expression tag
Glu 15	-	expression tag
Lys 16	-	expression tag
Glu 17	-	expression tag
Asn 18	-	expression tag
Leu 19	-	expression tag
Tyr 20	-	expression tag
Phe 21	-	expression tag
Gln 22	-	expression tag
Gly 23	-	expression tag
Glu 495	-	expression tag
Asn 496	-	expression tag
Leu 497	-	expression tag
Tyr 498	-	expression tag
Phe 499	-	expression tag
Gln 500	-	expression tag
Gly 501	-	expression tag
Thr 502	-	expression tag
Glu 503	-	expression tag
Thr 504	-	expression tag
Ser 505	-	expression tag
Gln 506	-	expression tag
Val 507	-	expression tag
Ala 508	-	expression tag
Pro 509	-	expression tag
Ala 510	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	5
	Total formula weight	275970.7
Non-Polymers*	Number of molecules	53
	Total formula weight	18831.7
All*	Total formula weight	294802.4

*Water molecules are not included.