PDB-code
| Kinase structure | |
| Kinase: | TLK2 |
| Family: | TLK |
| Group: | Other |
| Species: | HUMAN |
| IUPHAR/BPS ID: | 2243 |
| PDB: | 5O0Y |
| sc-PDB: | |
| KIDFamMap: | Search |
| Release date: | 2018-05-30 |
| PubMed: | 29955062 |
| Chain: | A |
| Orthosteric ligand: | AGS |
 | |
| Structural information | |
| DFG conformation: | in |
| αC-helix conformation: | in |
| G-rich loop angle (distance): | 62.3° (18.9Å) |
| G-rich loop rotation: | 60.7° |
| Quality Score: | 8 |
| Resolution: | 2.86 Å |
| Missing Residues: | 0 |
| Missing Atoms: | 0 |
| Ligand binding mode | ||||
| Pockets | Subpockets | |||
| front | FP-II | |||
| Pocket alignment | |
| Uniprot sequence: | HLLGRGGFSEVYKVAVKIHHACREYRIHKELDPRIVKLYDYCTVLEYCEGNDLDFYLKQNEIKPPIIHYDLKPGNILLITDFGLS |
| Sequence structure: | HLLGRGGFSEVYKVAVKIHHACREYRIHKELDPRIVKLYDYCTVLEYCEGNDLDFYLKQNEIKPPIIHYDLKPGNILLITDFGLS |
| Ligand affinity | |
| ChEMBL ID: | CHEMBL131890 |
| 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 H 466 | 2 L 467 | 3 L 468 | 4 G 469 | 5 R 470 | 6 G 471 | 7 G 472 | 8 F 473 | 9 S 474 | 10 E 475 | 11 V 476 | 12 Y 477 | 13 K 478 | 14 V 488 | 15 A 489 | 16 V 490 | 17 K 491 | 18 I 492 | 19 H 493 | 20 H 510 |
| • | • | • | • | • | • | • | • | •• | |||||||||||
| αC | b.l | IV | |||||||||||||||||
| 21 A 511 | 22 C 512 | 23 R 513 | 24 E 514 | 25 Y 515 | 26 R 516 | 27 I 517 | 28 H 518 | 29 K 519 | 30 E 520 | 31 L 521 | 32 D 522 | 33 P 524 | 34 R 525 | 35 I 526 | 36 V 527 | 37 K 528 | 38 L 529 | 39 Y 530 | 40 D 531 |
| IV | V | GK | hinge | linker | αD | αE | |||||||||||||
| 41 Y 532 | 42 C 541 | 43 T 542 | 44 V 543 | 45 L 544 | 46 E 545 | 47 Y 546 | 48 C 547 | 49 E 548 | 50 G 549 | 51 N 550 | 52 D 551 | 53 L 552 | 54 D 553 | 55 F 554 | 56 Y 555 | 57 L 556 | 58 K 557 | 59 Q 558 | 60 N 582 |
| • | •• | •• | |||||||||||||||||
| αE | VI | c.l | VII | VIII | x | ||||||||||||||
| 61 E 583 | 62 I 584 | 63 K 585 | 64 P 586 | 65 P 587 | 66 I 588 | 67 I 589 | 68 H 590 | 69 Y 591 | 70 D 592 | 71 L 593 | 72 K 594 | 73 P 595 | 74 G 596 | 75 N 597 | 76 I 598 | 77 L 599 | 78 L 600 | 79 I 611 | 80 T 612 |
| DFG | a.l | ||||||||||||||||||
| 81 D 613 | 82 F 614 | 83 G 615 | 84 L 616 | 85 S 617 | |||||||||||||||
Interaction pattern search
Search KLIFS for kinase-ligand complexes with similar interaction patterns:
