6WXZ
CRYSTAL STRUCTURE OF MYELOPEROXIDASE SUBFORM C (MPO) COMPLEX WITH Compound-29 A.K.A 7-(1,2-DIPHENYLETHYL)-1H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN-5-AMINE
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, D | Myeloperoxidase light chain | polymer | 105 | 11974.4 | 2 | UniProt (P05164) In PDB | Homo sapiens (Human) | MPO |
2 | B, E | Myeloperoxidase heavy chain | polymer | 467 | 53321.3 | 2 | UniProt (P05164) Pfam (PF03098) In PDB | Homo sapiens (Human) | MPO |
3 | C, H | alpha-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 367.3 | 2 | In PDB GlyTouCan (G86851RC) | |||
4 | F, G | alpha-D-mannopyranose-(1-6)-beta-D-mannopyranose | branched | 342.3 | 2 | In PDB GlyTouCan (G71124KE) | |||
5 | E, A, B, D | CHLORIDE ION | non-polymer | 35.5 | 4 | Chemie (CL) | |||
6 | A, D | CALCIUM ION | non-polymer | 40.1 | 2 | Chemie (CA) | |||
7 | B, E | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 8 | Chemie (NAG) | |||
8 | B, E | HEME C | non-polymer | 618.5 | 2 | Chemie (HEC) | |||
9 | E, B | 7-[(1R)-1,2-diphenylethyl]-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine | non-polymer | 315.4 | 2 | Chemie (UEY) | |||
10 | B, E | alpha-D-mannopyranose | non-polymer | 180.2 | 2 | Chemie (MAN) | |||
11 | water | water | 18.0 | 432 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 4 |
Total formula weight | 130591.4 | |
Branched | Number of molecules | 4 |
Total formula weight | 1419.3 | |
Non-Polymers* | Number of molecules | 20 |
Total formula weight | 4219.7 | |
All* | Total formula weight | 136230.4 |