7S2P

Crystal structure of the F337L mutation of Trypanosoma cruzi glucokinase in complex with inhibitor CBZ-GlcN

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Glucokinase 1	polymer	381	42192.6	2	UniProt (Q4E4E1) Pfam (PF02685) In PDB	Trypanosoma cruzi (strain CL Brener)
2	A, B	2-{[(benzyloxy)carbonyl]amino}-2-deoxy-beta-D-glucopyranose	non-polymer		313.3	2	Chemie (4UZ)
3	A	SULFATE ION	non-polymer		96.1	1	Chemie (SO4)
4		water	water		18.0	52	Chemie (HOH)

Sequence modifications

A, B: 1 - 367 (UniProt: Q4E4E1)

PDB	External Database	Details
Met -13	-	initiating methionine
Gly -12	-	expression tag
Arg -11	-	expression tag
Gly -10	-	expression tag
Ser -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
Gly -2	-	expression tag
Met -1	-	expression tag
Ala 0	-	expression tag
Leu 337	Phe 337	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	84385.3
Non-Polymers*	Number of molecules	3
	Total formula weight	722.7
All*	Total formula weight	85107.9

*Water molecules are not included.