3OPD

Crystal Structure of the N-terminal domain of an HSP90 from Trypanosoma Brucei, Tb10.26.1080 in the presence of a benzamide derivative

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 (A, B, C)	Heat shock protein 83	polymer	231	26200.4	3	UniProt (P12861) Pfam (PF02518)	Trypanosoma brucei brucei
2	D, E, F (A, B, C)	4-[6,6-dimethyl-4-oxidanylidene-3-(trifluoromethyl)-5,7-dihydroindazol-1-yl]-2-[(4-oxidanylcyclohexyl)amino]benzamide	non-polymer		464.5	3	Chemie (E0G)
3	G, H, I (A, B, C)	water	water		18.0	359	Chemie (HOH)

Sequence modifications

A, B, C: 1 - 213 (UniProt: P12861)

PDB	External Database	Details
Met -17	-	initiating methionine
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
Ser -10	-	expression tag
Ser -9	-	expression tag
Gly -8	-	expression tag
Arg -7	-	expression tag
Glu -6	-	expression tag
Asn -5	-	expression tag
Leu -4	-	expression tag
Tyr -3	-	expression tag
Phe -2	-	expression tag
Gln -1	-	expression tag
Gly 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	78601.1
Non-Polymers*	Number of molecules	3
	Total formula weight	1393.4
All*	Total formula weight	79994.6

*Water molecules are not included.