6F9T
Crystal structure of human testis Angiotensin-1 converting enzyme in complex with Sampatrilat.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Angiotensin-converting enzyme | polymer | 591 | 68297.2 | 1 | UniProt (P12821) Pfam (PF01401) | Homo sapiens (Human) | ACE,Dipeptidyl carboxypeptidase I,Kininase II |
| 2 | B (B) | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 424.4 | 1 | In PDB GlyTouCan (G42666HT) | |||
| 3 | C (C) | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-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-glucopyranose | branched | 1463.3 | 1 | In PDB GlyTouCan (G80858MF) | |||
| 4 | D (A) | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 5 | E (A) | Sampatrilat | non-polymer | 584.7 | 1 | Chemie (D0Z) | |||
| 6 | F, G (A) | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
| 7 | H, I (A) | IMIDAZOLE | non-polymer | 69.1 | 2 | Chemie (IMD) | |||
| 8 | J (A) | BORIC ACID | non-polymer | 61.8 | 1 | Chemie (BO3) | |||
| 9 | K, L, M (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 3 | Chemie (EDO) | |||
| 10 | N, O, P (A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 3 | Chemie (PEG) | |||
| 11 | Q (A) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 1 | Chemie (PGE) | |||
| 12 | R (A) | water | water | 18.0 | 678 | Chemie (HOH) |
Sequence modifications
A: 37 - 627 (UniProt: P12821)
| PDB | External Database | Details |
|---|---|---|
| Gly 64 | Glu 669 | conflict |
| Gln 90 | Asn 695 | conflict |
| Gln 155 | Asn 760 | conflict |
| Gln 337 | Asn 942 | conflict |
| Gln 586 | Asn 1191 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 68297.2 | |
| Branched | Number of molecules | 2 |
| Total formula weight | 1887.8 | |
| Non-Polymers* | Number of molecules | 14 |
| Total formula weight | 1575.7 | |
| All* | Total formula weight | 71760.7 |
