8GMI

Citrate Synthase (CitA) in Mycobacterium tuberculosis modified by Ebselen at C143 residue

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...	citrate synthase	polymer	379	41019.6	8	UniProt (A0A045JB88) Pfam (PF00285) UniProt (by SIFTS) (P9WPD3) In PDB	Mycobacterium tuberculosis H37Rv
2	A, B, C, D, E...	N-phenyl-2-selanylbenzamide	non-polymer		276.2	8	Chemie (9JT)
3	B, C, D, E, F	CITRATE ANION	non-polymer		189.1	5	Chemie (FLC)
4		water	water		18.0	118	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F, G, H: 1 - 373 (UniProt: A0A045JB88)

PDB	External Database	Details
His 374	-	expression tag
His 375	-	expression tag
His 376	-	expression tag
His 377	-	expression tag
His 378	-	expression tag
His 379	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	8
	Total formula weight	328156.8
Non-Polymers*	Number of molecules	13
	Total formula weight	3155.0
All*	Total formula weight	331311.9

*Water molecules are not included.