9ZRW

Alpha 1-AntiTrypsin (C232S) in Complex with B211421

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Alpha-1-antitrypsin	polymer	404	45595.7	1	UniProt (P01009) Pfam (PF00079)	Homo sapiens (human)	Alpha-1 protease inhibitor,Alpha-1-antiproteinase,Serpin A1
2	B (A)	N-[(1S,2R)-1-(2-chloro-3-fluorophenyl)-1-hydroxypentan-2-yl]-7-fluoro-2-oxo-2,3-dihydro-1H-indole-4-carboxamide	non-polymer		408.8	1	Chemie (A1C33)
3	C, D, E (A)	GLYCEROL	non-polymer		92.1	3	Chemie (GOL) PubChem (753)
4	F (A)	water	water		18.0	179	Chemie (HOH)

Sequence modifications

A: 2 - 394 (UniProt: P01009)

PDB	External Database	Details
Met -9	-	expression tag
Arg -8	-	expression tag
Gly -7	-	expression tag
Ser -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
Thr 1	-	expression tag
Ser 232	Cys 256	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	45595.7
Non-Polymers*	Number of molecules	4
	Total formula weight	685.1
All*	Total formula weight	46280.8

*Water molecules are not included.