3PEJ

Crystal Structure of the N-terminal domain of an HSP90 from Plasmodium Falciparum, PFL1070c in the presence of Macbecin

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Endoplasmin homolog	polymer	281	32065.3	2	UniProt (Q8I0V4) Pfam (PF13589)	Plasmodium falciparum 3D7
2	C, E (A, B)	MACBECIN	non-polymer		558.7	2	Chemie (BC2) PubChem (20786720) PubChem (22524979) PubChem (23229054) PubChem (23425243) PubChem (24199491) PubChem (177408296) PubChem (98218988) PubChem (98218990) PubChem (6436263) PubChem (122173109) PubChem (138107724) PubChem (13267717) PubChem (162984785) PubChem (162984789) PubChem (59996476) PubChem (67495410) PubChem (67495412) PubChem (70824163) PubChem (98218987) PubChem (98218989) PubChem (99719506) PubChem (433447) PubChem (5458728) PubChem (5477570) PubChem (5858310) PubChem (10392986) PubChem (10886216) PubChem (137347516) PubChem (137699317) PubChem (140580354) PubChem (156595903) PubChem (162984786) PubChem (162984787) PubChem (162984788) PubChem (168012345) PubChem (168314096) PubChem (171318957) PubChem (171337504) PubChem (172014669)
3	D, F, G (A, B)	SULFATE ION	non-polymer		96.1	3	Chemie (SO4)

Sequence modifications

A, B: 68 - 330 (UniProt: Q8I0V4)

PDB	External Database	Details
Met 50	-	expression tag
His 51	-	expression tag
His 52	-	expression tag
His 53	-	expression tag
His 54	-	expression tag
His 55	-	expression tag
His 56	-	expression tag
Ser 57	-	expression tag
Ser 58	-	expression tag
Gly 59	-	expression tag
Arg 60	-	expression tag
Glu 61	-	expression tag
Asn 62	-	expression tag
Leu 63	-	expression tag
Tyr 64	-	expression tag
Phe 65	-	expression tag
Gln 66	-	expression tag
Gly 67	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	64130.6
Non-Polymers*	Number of molecules	5
	Total formula weight	1405.5
All*	Total formula weight	65536.1

*Water molecules are not included.