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6F9V

Crystal structure of human Angiotensin-1 converting enzyme N-domain in complex with Sampatrilat.

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, BAngiotensin-converting enzymepolymer62972592.52UniProt (P12821)
Pfam (PF01401)
In PDB
Homo sapiens (Human)ACE,Dipeptidyl carboxypeptidase I,Kininase II
2Calpha-D-mannopyranose-(1-6)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranosebranched894.81In PDB
GlyTouCan (G00395TQ)
3D2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranosebranched570.51In PDB
GlyTouCan (G21290RB)
4A, BZINC IONnon-polymer65.42Chemie (ZN)
5A, BSampatrilatnon-polymer584.72Chemie (D0Z)
6A, BCHLORIDE IONnon-polymer35.54Chemie (CL)
7A, B2-acetamido-2-deoxy-beta-D-glucopyranosenon-polymer221.24Chemie (NAG)
8A, BMAGNESIUM IONnon-polymer24.33Chemie (MG)
9B, A1,2-ETHANEDIOLnon-polymer62.17Chemie (EDO)
10B, ADI(HYDROXYETHYL)ETHERnon-polymer106.12Chemie (PEG)
11ATETRAETHYLENE GLYCOLnon-polymer194.21Chemie (PG4)
12BTRIETHYLENE GLYCOLnon-polymer150.22Chemie (PGE)
13B3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOLnon-polymer326.41Chemie (P33)
14waterwater18.0950Chemie (HOH)
Sequence modifications
A, B: 1 - 628 (UniProt: P12821)
PDBExternal DatabaseDetails
Gln 9Asn 38conflict
Gln 25Asn 54conflict
Gln 82Asn 111conflict
Gln 117Asn 146conflict
Gln 289Asn 318conflict
Arg 545Gln 574conflict
Leu 576Pro 605conflict
Leu 629-expression tag
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains2
Total formula weight145185.0
BranchedNumber of molecules2
Total formula weight1465.4
Non-Polymers*Number of molecules28
Total formula weight3867.4
All*Total formula weight150517.7
*Water molecules are not included.

222036

PDB entries from 2024-07-03

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