5TYJ

alpha-esterase-7 in complex with (3-bromo-5-phenoxylphenyl)boronic acid

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Carboxylic ester hydrolase	polymer	577	66446.9	1	UniProt (Q25252) Pfam (PF00135) In PDB	Lucilia cuprina (Green bottle fly)
2	A	(3-bromo-5-phenoxyphenyl)boronic acid	non-polymer		292.9	1	Chemie (7ND)
3		water	water		18.0	205	Chemie (HOH)

Sequence modifications

A: 1 - 570 (UniProt: Q25252)

PDB	External Database	Details
Met -6	-	initiating methionine
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Ala 83	Asp 83	engineered mutation
Asp 137	Gly 137	engineered mutation
Leu 364	Met 364	engineered mutation
Phe 419	Ile 419	engineered mutation
Thr 472	Ala 472	engineered mutation
Thr 505	Ile 505	engineered mutation
Glu 530	Lys 530	engineered mutation
Gly 554	Asp 554	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	66446.9
Non-Polymers*	Number of molecules	1
	Total formula weight	292.9
All*	Total formula weight	66739.8

*Water molecules are not included.