8E9Y

CryoEM structure of miniGq-coupled hM3Dq in complex with CNO

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Muscarinic acetylcholine receptor M3	polymer	568	62892.6	1	UniProt (P20309) Pfam (PF00001) In PDB	Homo sapiens (human)
2	B	miniGq	polymer	246	28084.8	1		Homo sapiens
3	C	Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1	polymer	368	39798.4	1	UniProt (P62873) Pfam (PF00400) In PDB	Homo sapiens (human)	Transducin beta chain 1
4	D	Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2	polymer	71	7861.1	1	UniProt (P59768) Pfam (PF00631) In PDB	Homo sapiens (human)	G gamma-I
5	E	scFv16	polymer	251	26679.7	1		Homo sapiens
6	A	8-chloro-11-(4-methyl-4-oxo-4lambda~5~-piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine	non-polymer		342.8	1	Chemie (WE9)

Sequence modifications

A: 46 - 463 (UniProt: P20309)

PDB	External Database	Details
Cys 149	Tyr 149	conflict
Gly 239	Ala 239	conflict

A: 464 - 590 (UniProt: P20309)

PDB	External Database	Details
Gly 591	-	expression tag
Gly 592	-	expression tag
Ser 593	-	expression tag
Gly 594	-	expression tag
Gly 595	-	expression tag
Gly 596	-	expression tag
Gly 597	-	expression tag
Ser 598	-	expression tag
Gly 599	-	expression tag
Gly 600	-	expression tag
Ser 601	-	expression tag
Ser 602	-	expression tag
Ser 603	-	expression tag
Gly 604	-	expression tag
Gly 605	-	expression tag
Gly 606	-	expression tag
Gly 607	-	expression tag
Ser 608	-	expression tag
Gly 609	-	expression tag
Gly 610	-	expression tag
Gly 611	-	expression tag
Gly 612	-	expression tag
Ser 613	-	expression tag
Gly 614	-	expression tag
Gly 615	-	expression tag
Ser 616	-	expression tag
Ser 617	-	expression tag
Ser 618	-	expression tag
Gly 619	-	expression tag
Gly 620	-	expression tag
Val 621	-	expression tag
Phe 622	-	expression tag
Thr 623	-	expression tag
Leu 624	-	expression tag
Glu 625	-	expression tag
Asp 626	-	expression tag
Phe 627	-	expression tag
Val 628	-	expression tag
Gly 629	-	expression tag
Asp 630	-	expression tag
Trp 631	-	expression tag
Glu 632	-	expression tag
Gln 633	-	expression tag
Thr 634	-	expression tag
Ala 635	-	expression tag
Ala 636	-	expression tag
Tyr 637	-	expression tag
Asn 638	-	expression tag
Leu 639	-	expression tag
Asp 640	-	expression tag
Gln 641	-	expression tag
Val 642	-	expression tag
Leu 643	-	expression tag
Glu 644	-	expression tag
Gln 645	-	expression tag
Gly 646	-	expression tag
Gly 647	-	expression tag
Val 648	-	expression tag
Ser 649	-	expression tag
Ser 650	-	expression tag
Leu 651	-	expression tag
Leu 652	-	expression tag
Gln 653	-	expression tag
Asn 654	-	expression tag
Leu 655	-	expression tag
Ala 656	-	expression tag
Val 657	-	expression tag
Ser 658	-	expression tag
Val 659	-	expression tag
Thr 660	-	expression tag
Pro 661	-	expression tag
Ile 662	-	expression tag
Gln 663	-	expression tag
Arg 664	-	expression tag
Ile 665	-	expression tag
Val 666	-	expression tag
Arg 667	-	expression tag
Ser 668	-	expression tag
Gly 669	-	expression tag
Glu 670	-	expression tag
Asn 671	-	expression tag
Ala 672	-	expression tag
Leu 673	-	expression tag
Lys 674	-	expression tag
Ile 675	-	expression tag
Asp 676	-	expression tag
Ile 677	-	expression tag
His 678	-	expression tag
Val 679	-	expression tag
Ile 680	-	expression tag
Ile 681	-	expression tag
Pro 682	-	expression tag
Tyr 683	-	expression tag
Glu 684	-	expression tag
Gly 685	-	expression tag
Leu 686	-	expression tag
Ser 687	-	expression tag
Ala 688	-	expression tag
Asp 689	-	expression tag
Gln 690	-	expression tag
Met 691	-	expression tag
Ala 692	-	expression tag
Gln 693	-	expression tag
Ile 694	-	expression tag
Glu 695	-	expression tag
Glu 696	-	expression tag
Val 697	-	expression tag
Phe 698	-	expression tag
Lys 699	-	expression tag
Val 700	-	expression tag
Val 701	-	expression tag
Tyr 702	-	expression tag
Pro 703	-	expression tag
Val 704	-	expression tag
Asp 705	-	expression tag
Asp 706	-	expression tag
His 707	-	expression tag
His 708	-	expression tag
Phe 709	-	expression tag
Lys 710	-	expression tag
Val 711	-	expression tag
Ile 712	-	expression tag
Leu 713	-	expression tag
Pro 714	-	expression tag
Tyr 715	-	expression tag
Gly 716	-	expression tag
Thr 717	-	expression tag
Leu 718	-	expression tag
Val 719	-	expression tag
Ile 720	-	expression tag
Asp 721	-	expression tag
Gly 722	-	expression tag
Val 723	-	expression tag
Thr 724	-	expression tag
Pro 725	-	expression tag
Asn 726	-	expression tag
Met 727	-	expression tag
Leu 728	-	expression tag
Asn 729	-	expression tag
Tyr 730	-	expression tag
Phe 731	-	expression tag
Gly 732	-	expression tag
Arg 733	-	expression tag
Pro 734	-	expression tag
Tyr 735	-	expression tag
Glu 736	-	expression tag
Gly 737	-	expression tag
Ile 738	-	expression tag
Ala 739	-	expression tag
Val 740	-	expression tag
Phe 741	-	expression tag
Asp 742	-	expression tag
Gly 743	-	expression tag
Lys 744	-	expression tag
Lys 745	-	expression tag
Ile 746	-	expression tag
Thr 747	-	expression tag
Val 748	-	expression tag
Thr 749	-	expression tag
Gly 750	-	expression tag
Thr 751	-	expression tag
Leu 752	-	expression tag
Trp 753	-	expression tag
Asn 754	-	expression tag
Gly 755	-	expression tag
Asn 756	-	expression tag
Lys 757	-	expression tag
Ile 758	-	expression tag
Ile 759	-	expression tag
Asp 760	-	expression tag
Glu 761	-	expression tag
Arg 762	-	expression tag
Leu 763	-	expression tag
Ile 764	-	expression tag
Thr 765	-	expression tag
Pro 766	-	expression tag
Asp 767	-	expression tag
Gly 768	-	expression tag
Ser 769	-	expression tag
Met 770	-	expression tag
Leu 771	-	expression tag
Phe 772	-	expression tag
Arg 773	-	expression tag
Val 774	-	expression tag
Thr 775	-	expression tag
Ile 776	-	expression tag
Asn 777	-	expression tag
Ser 778	-	expression tag
Gly 779	-	expression tag
Gly 780	-	expression tag
Ser 781	-	expression tag
Gly 782	-	expression tag
Gly 783	-	expression tag
His 784	-	expression tag
His 785	-	expression tag
His 786	-	expression tag
His 787	-	expression tag
His 788	-	expression tag
His 789	-	expression tag
His 790	-	expression tag
His 791	-	expression tag
His 792	-	expression tag
His 793	-	expression tag

C: 2 - 340 (UniProt: P62873)

PDB	External Database	Details
Gly 341	-	expression tag
Gly 342	-	expression tag
Ser 343	-	expression tag
Gly 344	-	expression tag
Gly 345	-	expression tag
Gly 346	-	expression tag
Gly 347	-	expression tag
Ser 348	-	expression tag
Gly 349	-	expression tag
Gly 350	-	expression tag
Ser 351	-	expression tag
Ser 352	-	expression tag
Ser 353	-	expression tag
Gly 354	-	expression tag
Gly 355	-	expression tag
Val 356	-	expression tag
Ser 357	-	expression tag
Gly 358	-	expression tag
Trp 359	-	expression tag
Arg 360	-	expression tag
Leu 361	-	expression tag
Phe 362	-	expression tag
Lys 363	-	expression tag
Lys 364	-	expression tag
Ile 365	-	expression tag
Ser 366	-	expression tag
Gly 367	-	expression tag
Gly 368	-	expression tag
Ser 369	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	5
	Total formula weight	165316.7
Non-Polymers*	Number of molecules	1
	Total formula weight	342.8
All*	Total formula weight	165659.5

*Water molecules are not included.