7SS6

Structure of Klebsiella LpxH in complex with JH-LPH-45

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	UDP-2,3-diacylglucosamine hydrolase	polymer	259	29627.7	1	UniProt (A0A1S0WIC1) Pfam (PF00149) UniProt (by SIFTS) (A6T5R0)	Klebsiella pneumoniae	UDP-2,3-diacylglucosamine diphosphatase
2	B, C (A)	MANGANESE (II) ION	non-polymer		54.9	2	Chemie (MN)
3	D (A)	5-{4-[3-chloro-5-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-N-[5-(hydroxyamino)-5-oxopentyl]-2,3-dihydro-1H-indole-1-carboxamide	non-polymer		604.0	1	Chemie (BKB)
4	E, F, G, H (A)	1,2-ETHANEDIOL	non-polymer		62.1	4	Chemie (EDO)
5	I (A)	water	water		18.0	152	Chemie (HOH)

Sequence modifications

A: 1 - 240 (UniProt: A0A1S0WIC1)

PDB	External Database	Details
Leu 241	-	expression tag
Glu 242	-	expression tag
Glu 243	-	expression tag
Asn 244	-	expression tag
Leu 245	-	expression tag
Tyr 246	-	expression tag
Phe 247	-	expression tag
Gln 248	-	expression tag
Ser 249	-	expression tag
His 250	-	expression tag
His 251	-	expression tag
His 252	-	expression tag
His 253	-	expression tag
His 254	-	expression tag
His 255	-	expression tag
His 256	-	expression tag
His 257	-	expression tag
His 258	-	expression tag
His 259	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	29627.7
Non-Polymers*	Number of molecules	7
	Total formula weight	962.2
All*	Total formula weight	30589.9

*Water molecules are not included.