11MI
Crystal Structure of M. tuberculosis ClpP1P2 bound to ADEP 19
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D, E... (A, B, C, D, E...) | ATP-dependent Clp protease proteolytic subunit 2 | polymer | 214 | 23650.9 | 14 | UniProt (P9WPC3) Pfam (PF00574) | Mycobacterium tuberculosis H37Rv | Endopeptidase Clp 2 |
| 2 | AA, BA, H, I, J... (H, I, J, K, L...) | ATP-dependent Clp protease proteolytic subunit 1 | polymer | 194 | 21065.9 | 14 | UniProt (P9WPC5) Pfam (PF00574) | Mycobacterium tuberculosis H37Rv | Endopeptidase Clp 1 |
| 3 | CA, CC, DB, DD, GA... (A, O, G, U, B...) | 3,5-difluoro-N-[(5R,6aS,8R,10R,12S,13S,15aS,19R,21S,23aS)-8-fluoro-13,21-dimethyl-6,11,15,20,23-pentaoxooctadecahydro-2H,6H,11H,15H-pyrido[2,1-i]dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13]oxatetraazacyclohexadecin-12-yl]-Nalpha-{(2E)-3-[(1S,2R)-2-methylcyclopentyl]prop-2-enoyl}-L-phenylalaninamide | non-polymer | 814.9 | 14 | Chemie (A1C9P) | |||
| 4 | AD, DA, DC, EB, ED... (T, A, O, G, U...) | BENZOIC ACID | non-polymer | 122.1 | 28 | Chemie (BEZ) | |||
| 5 | AB, AC, AE, BB, BC... (F, N, b, T, A...) | LEUCINE | non-polymer | 131.2 | 56 | Chemie (LEU) PubChem (6106) | |||
| 6 | CB, GC, OA, PC (F, O, C, Q) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 4 | Chemie (DMS) PubChem (679) | |||
| 7 | TA, YC (D, S) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 2 | Chemie (PEG) PubChem (8117) | |||
| 8 | AF, BF, CE, CF, DE... (Y, Z, A, a, B...) | water | water | 18.0 | 458 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, O, P, Q, R, S, T, U: 13 - 214 (UniProt: P9WPC3)
| PDB | External Database | Details |
|---|---|---|
| Met 12 | - | initiating methionine |
| Ala 215 | - | expression tag |
| Ala 216 | - | expression tag |
| Ala 217 | - | expression tag |
| Leu 218 | - | expression tag |
| Glu 219 | - | expression tag |
| His 220 | - | expression tag |
| His 221 | - | expression tag |
| His 222 | - | expression tag |
| His 223 | - | expression tag |
| His 224 | - | expression tag |
| His 225 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 28 |
| Total formula weight | 626035.8 | |
| Non-Polymers* | Number of molecules | 104 |
| Total formula weight | 22698.3 | |
| All* | Total formula weight | 648734.1 |
