4HVA
Mechanistic and Structural Understanding of Uncompetitive Inhibitors of Caspase-6
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Caspase-6 | polymer | 265 | 30467.9 | 2 | UniProt (P55212) Pfam (PF00656) In PDB | Homo sapiens (human) | CASP-6, Apoptotic protease Mch-2, Caspase-6 subunit p18, Caspase-6 subunit p11 |
2 | C, D | VEID Inhibitor | polymer | 5 | 789.2 | 2 | BIRD (PRD_000960) | ||
3 | A, B | N-[(2R)-1-(3-cyanophenyl)-3-hydroxypropan-2-yl]-5-(3,4-dimethoxyphenyl)furan-3-carboxamide | non-polymer | 406.4 | 2 | Chemie (4HV) | |||
4 | water | water | 18.0 | 278 | Chemie (HOH) |
Sequence modifications
A, B: 24 - 293 (UniProt: P55212)
PDB | External Database | Details |
---|---|---|
- | Val 178 | DELETION |
- | Asp 179 | DELETION |
- | Asn 180 | DELETION |
- | Gln 181 | DELETION |
- | Thr 182 | DELETION |
- | Glu 183 | DELETION |
- | Lys 184 | DELETION |
- | Leu 185 | DELETION |
- | Asp 186 | DELETION |
- | Thr 187 | DELETION |
- | Asn 188 | DELETION |
- | Ile 189 | DELETION |
- | Thr 190 | DELETION |
- | Glu 191 | DELETION |
Gly 294 | - | EXPRESSION TAG |
Asn 295 | - | EXPRESSION TAG |
Ser 296 | - | EXPRESSION TAG |
His 297 | - | EXPRESSION TAG |
His 298 | - | EXPRESSION TAG |
His 299 | - | EXPRESSION TAG |
His 300 | - | EXPRESSION TAG |
His 301 | - | EXPRESSION TAG |
His 302 | - | EXPRESSION TAG |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 4 |
Total formula weight | 62514.2 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 812.9 | |
All* | Total formula weight | 63327.1 |