2G22

Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Renin	polymer	333	36566.2	2	UniProt (P00797) Pfam (PF00026) In PDB	Homo sapiens (human)	Angiotensinogenase
2	A, B	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	2	Chemie (NAG)
3	A, B	6-ETHYL-5-[1-(3-METHOXYPROPYL)-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]-N~4~-(2-PHENYLETHYL)PYRIMIDINE-2,4-DIAMINE	non-polymer		445.6	2	Chemie (6IG)
4		water	water		18.0	87	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	73132.5
Non-Polymers*	Number of molecules	4
	Total formula weight	1333.6
All*	Total formula weight	74466.1

*Water molecules are not included.