PDB-code
| Kinase structure | |
| Kinase: | WNK3 (Wnk3) |
| Family: | WNK |
| Group: | Other |
| Species: | HUMAN |
| IUPHAR/BPS ID: | 2282 |
| PDB: | 5O26 |
| sc-PDB: | |
| KIDFamMap: | Search |
| Release date: | 2017-06-28 |
| Chain: | A |
| (Alternate) Model: | A |
| Orthosteric ligand: | ANP |
 | |
| More entries for 5O26 | |||||
| 5O26 | Alternative model: | A | Chain: | B | |
| 5O26 | Alternative model: | B | Chain: | A | |
| 5O26 | Alternative model: | B | Chain: | B | |
| Structural information | |
| DFG conformation: | in |
| αC-helix conformation: | out |
| G-rich loop angle (distance): | 51.9° (14.5Å) |
| G-rich loop rotation: | 28.7° |
| Quality Score: | 9.4 |
| Resolution: | 2.38 Å |
| Missing Residues: | 0 |
| Missing Atoms: | 6 |
| Ligand binding mode | ||||
| Pockets | Subpockets | Waters | ||
| front | Cluster I3 I5 I6 I11 | Ligand No No Yes No | Protein Yes Yes Yes Yes | |
| Pocket alignment | |
| Uniprot sequence: | IELGRGAFKTVYKVAWCELRFKEEAEMLKGLQPNIVRFYDSVLVTELMTSGTLKTYLKRHTRTPPIIHRDLKCDNIFIIGDLGLA |
| Sequence structure: | IELGRGAFKTVYKVAWCELRFKEEAEMLKGLQPNIVRFYDSVLVTELMTSGTLKTYLKRHTRTPPIIHRDLKCDNIFIIGDLGLA |
| Ligand affinity | |
| ChEMBL ID: | CHEMBL1230989 |
| Bioaffinities: | No (p)Ki/(p)IC50/(p)EC50 values for kinases found (confidence ≥ 8). |
Kinase-ligand interaction pattern
• Hydrophobic • Aromatic face-to-face • Aromatic face-to-edge • H-bond donor • H-bond acceptor • Ionic positive • Ionic negative
| I | g.l | II | III | αC | |||||||||||||||
| 1 I 151 | 2 E 152 | 3 L 153 | 4 G 154 | 5 R 155 | 6 G 156 | 7 A 157 | 8 F 158 | 9 K 159 | 10 T 160 | 11 V 161 | 12 Y 162 | 13 K 163 | 14 V 173 | 15 A 174 | 16 W 175 | 17 C 176 | 18 E 177 | 19 L 178 | 20 R 190 |
| • | • | • | • | • | •• | • | • | ||||||||||||
| αC | b.l | IV | |||||||||||||||||
| 21 F 191 | 22 K 192 | 23 E 193 | 24 E 194 | 25 A 195 | 26 E 196 | 27 M 197 | 28 L 198 | 29 K 199 | 30 G 200 | 31 L 201 | 32 Q 202 | 33 P 204 | 34 N 205 | 35 I 206 | 36 V 207 | 37 R 208 | 38 F 209 | 39 Y 210 | 40 D 211 |
| IV | V | GK | hinge | linker | αD | αE | |||||||||||||
| 41 S 212 | 42 V 224 | 43 L 225 | 44 V 226 | 45 T 227 | 46 E 228 | 47 L 229 | 48 M 230 | 49 T 231 | 50 S 232 | 51 G 233 | 52 T 234 | 53 L 235 | 54 K 236 | 55 T 237 | 56 Y 238 | 57 L 239 | 58 K 240 | 59 R 241 | 60 H 265 |
| • | • | •• | |||||||||||||||||
| αE | VI | c.l | VII | VIII | x | ||||||||||||||
| 61 T 266 | 62 R 267 | 63 T 268 | 64 P 269 | 65 P 270 | 66 I 271 | 67 I 272 | 68 H 273 | 69 R 274 | 70 D 275 | 71 L 276 | 72 K 277 | 73 C 278 | 74 D 279 | 75 N 280 | 76 I 281 | 77 F 282 | 78 I 283 | 79 I 292 | 80 G 293 |
| • | • | •• | |||||||||||||||||
| DFG | a.l | ||||||||||||||||||
| 81 D 294 | 82 L 295 | 83 G 296 | 84 L 297 | 85 A 298 | |||||||||||||||
Interaction pattern search
Search KLIFS for kinase-ligand complexes with similar interaction patterns:
