3BWK

Crystal Structure of Falcipain-3 with Its inhibitor, K11017

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D (A, B, C, D)	Cysteine protease falcipain-3	polymer	243	27375.6	4	UniProt (Q9NBA7) Pfam (PF00112) UniProt (by SIFTS) (Q8IIL0)	Plasmodium falciparum
2	E, G, J, L (A, B, C, D)	N~2~-(morpholin-4-ylcarbonyl)-N-[(3S)-1-phenyl-5-(phenylsulfonyl)pentan-3-yl]-L-leucinamide	non-polymer		529.7	4	Chemie (C1P)
3	F, H, I, K, M (A, B, C, D)	SULFATE ION	non-polymer		96.1	5	Chemie (SO4)
4	N, O, P, Q (A, B, C, D)	water	water		18.0	497	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	109502.3
Non-Polymers*	Number of molecules	9
	Total formula weight	2599.1
All*	Total formula weight	112101.4

*Water molecules are not included.