8CCK

Crystal structure of Mycobacterium smegmatis thioredoxin reductase in complex with fragment F2X-Entry H07

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Thioredoxin reductase	polymer	319	34578.7	1	UniProt (I7FW12) Pfam (PF07992) UniProt (by SIFTS) (A0R7I9) In PDB	Mycolicibacterium smegmatis MC2 155
2	A	FLAVIN-ADENINE DINUCLEOTIDE	non-polymer		785.5	1	Chemie (FAD)
3	A	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
4	A	~{N}-(4-hydroxyphenyl)-2-pyrazol-1-yl-ethanamide	non-polymer		217.2	1	Chemie (U8X)
5	A	MAGNESIUM ION	non-polymer		24.3	1	Chemie (MG)
6		water	water		18.0	186	Chemie (HOH)

Sequence modifications

A: 1 - 311 (UniProt: I7FW12)

PDB	External Database	Details
Met -7	-	initiating methionine
Ala -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	34578.7
Non-Polymers*	Number of molecules	4
	Total formula weight	1119.2
All*	Total formula weight	35697.9

*Water molecules are not included.