9G1S

Fragment screening of FosAKP, cryo structure in complex with fragment F2X-entry H01

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)	Fosfomycin resistance protein	polymer	145	16309.3	2	UniProt (A0A0E1CQ35)	Klebsiella pneumoniae
2	C (A)	1,2-ETHANEDIOL	non-polymer		62.1	1	Chemie (EDO)
3	D, F (A, B)	MANGANESE (II) ION	non-polymer		54.9	2	Chemie (MN)
4	E (B)	~{N},~{N}-diethyl-2-(4-nitrophenoxy)ethanamine	non-polymer		238.3	1	Chemie (VOB)
5	G, H (A, B)	water	water		18.0	438	Chemie (HOH)

Sequence modifications

A, B: 1 - 139 (UniProt: A0A0E1CQ35)

PDB	External Database	Details
His 140	-	expression tag
His 141	-	expression tag
His 142	-	expression tag
His 143	-	expression tag
His 144	-	expression tag
His 145	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	32618.7
Non-Polymers*	Number of molecules	4
	Total formula weight	410.2
All*	Total formula weight	33028.9

*Water molecules are not included.