8TYG

Plasmodium vivax PMV-WM08 inhibitor complex

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Plasmepsin V	polymer	461	52682.5	1	UniProt (A5K302) Pfam (PF14543) Pfam (PF00026)	Plasmodium vivax Sal-1	PvPMV,Plasmepsin 5
2	B (B)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	1	In PDB GlyTouCan (G42666HT)
3	C (A)	(2E,4aR,7aS)-6-[3-(4-chlorophenyl)pyridin-2-yl]-7a-(2,5-difluorophenyl)-2-imino-3-methyloctahydro-4H-pyrrolo[3,4-d]pyrimidin-4-one	non-polymer		467.9	1	Chemie (SKC)
4	D (A)	6-tungstotellurate(VI)	non-polymer		1614.6	1	Chemie (TEW)
5	E, F (A)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	2	Chemie (NAG)
6	G (A)	2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL	non-polymer		122.1	1	Chemie (TRS)
7	H (A)	water	water		18.0	278	Chemie (HOH)

Sequence modifications

A: 35 - 476 (UniProt: A5K302)

PDB	External Database	Details
Gly 33	-	expression tag
Thr 34	-	expression tag
Leu 477	-	expression tag
Glu 478	-	expression tag
Asn 479	-	expression tag
Leu 480	-	expression tag
Tyr 481	-	expression tag
Phe 482	-	expression tag
Gln 483	-	expression tag
Gly 484	-	expression tag
Asp 485	-	expression tag
Tyr 486	-	expression tag
Lys 487	-	expression tag
Asp 488	-	expression tag
Asp 489	-	expression tag
Asp 490	-	expression tag
Asp 491	-	expression tag
Lys 492	-	expression tag
His 493	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	52682.5
Branched	Number of molecules	1
	Total formula weight	424.4
Non-Polymers*	Number of molecules	5
	Total formula weight	2647.1
All*	Total formula weight	55754.0

*Water molecules are not included.