4O2Z

Crystal Structure of MPK3 from Leishmania donovani, LdBPK_100540 in the presence of NVP-BBT594

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Mitogen-activated protein kinase 3, putative	polymer	377	43220.4	1	UniProt (E9BA99) Pfam (PF00069) UniProt (by SIFTS) (A0A3S7WR45) In PDB	Leishmania donovani
2	A	5-{[6-(acetylamino)pyrimidin-4-yl]oxy}-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}-2,3-dihydro-1H-indole-1-carboxamide	non-polymer		569.6	1	Chemie (046)
3		water	water		18.0	8	Chemie (HOH)

Sequence modifications

A: 19 - 377 (UniProt: E9BA99)

PDB	External Database	Details
Met 1	-	initiating methionine
His 2	-	expression tag
His 3	-	expression tag
His 4	-	expression tag
His 5	-	expression tag
His 6	-	expression tag
His 7	-	expression tag
Ser 8	-	expression tag
Ser 9	-	expression tag
Gly 10	-	expression tag
Arg 11	-	expression tag
Glu 12	-	expression tag
Asn 13	-	expression tag
Leu 14	-	expression tag
Tyr 15	-	expression tag
Phe 16	-	expression tag
Gln 17	-	expression tag
Gly 18	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	43220.4
Non-Polymers*	Number of molecules	1
	Total formula weight	569.6
All*	Total formula weight	43790.0

*Water molecules are not included.