2RJQ
Crystal structure of ADAMTS5 with inhibitor bound
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | ADAMTS-5 | polymer | 378 | 41651.2 | 1 | UniProt (Q9UNA0) Pfam (PF01421) Pfam (PF17771) Pfam (PF00090) | Homo sapiens (human) | A disintegrin and metalloproteinase with thrombospondin motifs 5, ADAM-TS 5, ADAM-TS5, Aggrecanase-2, ADMP-2, ADAM-TS 11 |
| 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, D (A) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 4 | E, F (A) | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
| 5 | G, H (A) | CALCIUM ION | non-polymer | 40.1 | 2 | Chemie (CA) | |||
| 6 | I (A) | 4-(N-HYDROXYAMINO)-2R-ISOBUTYL-2S-(2-THIENYLTHIOMETHYL)SUCCINYL-L-PHENYLALANINE-N-METHYLAMIDE | non-polymer | 477.6 | 1 | Chemie (BAT) | |||
| 7 | J (A) | water | water | 18.0 | 81 | Chemie (HOH) |
Sequence modifications
A: 262 - 628 (UniProt: Q9UNA0)
| PDB | External Database | Details |
|---|---|---|
| Gly 629 | - | expression tag |
| Ser 630 | - | expression tag |
| Ala 631 | - | expression tag |
| Trp 632 | - | expression tag |
| Ser 633 | - | expression tag |
| His 634 | - | expression tag |
| Pro 635 | - | expression tag |
| Gln 636 | - | expression tag |
| Phe 637 | - | expression tag |
| Glu 638 | - | expression tag |
| Lys 639 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 41651.2 | |
| Branched | Number of molecules | 1 |
| Total formula weight | 424.4 | |
| Non-Polymers* | Number of molecules | 7 |
| Total formula weight | 759.5 | |
| All* | Total formula weight | 42835.2 |
