4JYH
Crystal structure of RARbeta LBD in complex with selective agonist BMS948 [4-{[(8-phenylnaphthalen-2-yl)carbonyl]amino}benzoic acid]
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Retinoic acid receptor beta | polymer | 267 | 30197.0 | 2 | UniProt (P10826) Pfam (PF00104) | Homo sapiens (human) | RAR-beta, HBV-activated protein, Nuclear receptor subfamily 1 group B member 2, RAR-epsilon |
| 2 | C, D (C, G) | Nuclear receptor coactivator 1 | polymer | 13 | 1591.9 | 2 | UniProt (Q15788) | Homo sapiens | SRC-1 |
| 3 | E, F (A, B) | 4-{[(8-phenylnaphthalen-2-yl)carbonyl]amino}benzoic acid | non-polymer | 367.4 | 2 | Chemie (JYH) | |||
| 4 | G (G) | CITRATE ANION | non-polymer | 189.1 | 1 | Chemie (FLC) | |||
| 5 | H, I, J, K (A, B, C, G) | water | water | 18.0 | 115 | Chemie (HOH) |
Sequence modifications
A, B: 169 - 414 (UniProt: P10826)
| PDB | External Database | Details |
|---|---|---|
| Met 148 | - | expression tag |
| Gly 149 | - | expression tag |
| Ser 150 | - | expression tag |
| Ser 151 | - | expression tag |
| His 152 | - | expression tag |
| His 153 | - | expression tag |
| His 154 | - | expression tag |
| His 155 | - | expression tag |
| His 156 | - | expression tag |
| His 157 | - | expression tag |
| Ser 158 | - | expression tag |
| Ser 159 | - | expression tag |
| Gly 160 | - | expression tag |
| Leu 161 | - | expression tag |
| Val 162 | - | expression tag |
| Pro 163 | - | expression tag |
| Arg 164 | - | expression tag |
| Gly 165 | - | expression tag |
| Ser 166 | - | expression tag |
| His 167 | - | expression tag |
| Met 168 | - | expression tag |
| Met 407 | Leu 414 | SEE REMARK 999 |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 63577.8 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 923.9 | |
| All* | Total formula weight | 64501.7 |
