1P44

Targeting tuberculosis and malaria through inhibition of enoyl reductase: compound activity and structural data

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, E... (A, B, C, D, E...)	Enoyl-[acyl-carrier-protein] reductase [NADH]	polymer	269	28554.8	6	UniProt (P0A5Y6) Pfam (PF13561) UniProt (by SIFTS) (P9WGR1)	Mycobacterium tuberculosis	NADH-dependent enoyl-ACP reductase
2	G, I, K, M, O... (A, B, C, D, E...)	NICOTINAMIDE-ADENINE-DINUCLEOTIDE	non-polymer		663.4	6	Chemie (NAD)
3	H, J, L, N (A, B, C, D)	5-{[4-(9H-FLUOREN-9-YL)PIPERAZIN-1-YL]CARBONYL}-1H-INDOLE	non-polymer		393.5	4	Chemie (GEQ)
4	Q, R, S, T, U... (A, B, C, D, E...)	water	water		18.0	147	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	171328.7
Non-Polymers*	Number of molecules	10
	Total formula weight	5554.5
All*	Total formula weight	176883.2

*Water molecules are not included.