9XMJ
A Potent and Selective ROR gamma Inhibitor for the Treatment of Autoimmune Diseases
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, C, E, G (A, C, E, G) | Nuclear receptor ROR-gamma | polymer | 258 | 29754.3 | 4 | UniProt (P51449) Pfam (PF00104) | Homo sapiens (human) | Nuclear receptor RZR-gamma,Nuclear receptor subfamily 1 group F member 3,RAR-related orphan receptor C,Retinoid-related orphan receptor-gamma |
| 2 | B, D, F, H (B, D, F, H) | Nuclear receptor corepressor 2 | polymer | 22 | 2600.0 | 4 | UniProt (Q9Y618) | Homo sapiens (human) | N-CoR2,CTG repeat protein 26,SMAP270,Silencing mediator of retinoic acid and thyroid hormone receptor,SMRT,T3 receptor-associating factor,TRAC,Thyroid-,retinoic-acid-receptor-associated corepressor |
| 3 | I, J, K, L (A, C, E, G) | (4~{S})-4-[3-chloranyl-4-(2,2-dimethylpropoxy)phenyl]-~{N},~{N},6-trimethyl-2-oxidanylidene-3,4-dihydro-1~{H}-pyrimidine-5-carboxamide | non-polymer | 379.9 | 4 | Chemie (A1MCM) | |||
| 4 | M, N, O, P, Q... (A, B, C, D, E...) | water | water | 18.0 | 124 | Chemie (HOH) |
Sequence modifications
A, C, E, G: 261 - 518 (UniProt: P51449)
| PDB | External Database | Details |
|---|---|---|
| Ala 469 | Lys 469 | engineered mutation |
| Ala 473 | Arg 473 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 8 |
| Total formula weight | 129417.2 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1519.5 | |
| All* | Total formula weight | 130936.7 |
