6ZPL

Inward-open structure of human glycine transporter 1 in complex with a benzoylisoindoline inhibitor, sybody Sb_GlyT1#7 and bound Na and Cl ions.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (B, A)	Sodium- and chloride-dependent glycine transporter 1	polymer	576	64730.4	2	UniProt (P48067) Pfam (PF00209)	Homo sapiens (Human)	GlyT1,Solute carrier family 6 member 9
2	C (C)	Endoglucanase H	polymer	273	31163.5	1	UniProt (P16218) Pfam (PF02156)	Hungateiclostridium thermocellum (strain ATCC 27405 / DSM 1237 / JCM 9322 / NBRC 103400 / NCIMB 10682 / NRRL B-4536 / VPI 7372)	Cellulase H,Endo-1,4-beta-glucanase H,EgH
3	D, E (E, F)	Sybody Sb_GlyT1#7	polymer	120	13303.7	2		unidentified
4	F, I (B, A)	[5-fluoranyl-6-(oxan-4-yloxy)-1,3-dihydroisoindol-2-yl]-[5-methylsulfonyl-2-[2,2,3,3,3-pentakis(fluoranyl)propoxy]phenyl]methanone	non-polymer		567.5	2	Chemie (QET)
5	G, J (B, A)	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
6	H, K (B, A)	CHLORIDE ION	non-polymer		35.5	2	Chemie (CL)

Sequence modifications

B, A: 92 - 684 (UniProt: P48067)

PDB	External Database	Details
Ala 153	Leu 153	engineered mutation
-	Asn 240	deletion
-	Gly 241	deletion
-	Ser 242	deletion
-	Arg 243	deletion
-	Pro 244	deletion
-	Ala 245	deletion
-	Ala 246	deletion
-	Leu 247	deletion
-	Pro 248	deletion
-	Ser 249	deletion
-	Asn 250	deletion
-	Leu 251	deletion
-	Ser 252	deletion
-	His 253	deletion
-	Leu 254	deletion
-	Leu 255	deletion
-	Asn 256	deletion
Ala 297	Ser 297	engineered mutation
Ala 368	Ile 368	engineered mutation
Ala 633	Cys 633	engineered mutation

C: 9 - 281 (UniProt: P16218)

PDB	External Database	Details
Ala 109	Glu 131	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	5
	Total formula weight	187231.7
Non-Polymers*	Number of molecules	6
	Total formula weight	1251.9
All*	Total formula weight	188483.6

*Water molecules are not included.