FOCAL ADHESION KINASE CATALYTIC DOMAIN IN COMPLEX WITH Pyrrolo[2,3-d]thiazole. Determined by X-ray diffraction at 1.79 Å resolution. Released 21 Dec 2011.
Explore 3PXK in 3D Show helices and sheets RCSB PDB PDBe
3PXK contains 33 α-helices and 20 β-strands across 2 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.
| Element | Residues | Length | Sheet |
|---|---|---|---|
| β-strand | 416 | 1 | 1 |
| α-helix | 419-421 | 3 | |
| β-strand | 422-430 | 9 | 1 |
| β-strand | 435-441 | 7 | 1 |
| β-strand | 449-455 | 7 | 1 |
| α-helix | 462-475 | 14 | |
| β-strand | 483 | 1 | 2 |
| α-helix | 484-485 | 2 | |
| β-strand | 486-490 | 5 | 1 |
| α-helix | 495 | 1 | |
| β-strand | 496-500 | 5 | 1 |
| β-strand | 505-506 | 2 | 2 |
| α-helix | 507-513 | 7 | |
| α-helix | 520-539 | 20 | |
| α-helix | 549-551 | 3 | |
| β-strand | 552-556 | 5 | 2 |
| β-strand | 559-562 | 4 | 2 |
| α-helix | 591-596 | 6 | |
| α-helix | 601-616 | 16 | |
| α-helix | 620-621 | 2 | |
| α-helix | 628-636 | 9 | |
| α-helix | 641-644 | 4 | |
| α-helix | 649-658 | 10 | |
| α-helix | 663-665 | 3 | |
| α-helix | 667-668 | 2 | |
| α-helix | 669-686 | 18 |
| Element | Residues | Length | Sheet |
|---|---|---|---|
| β-strand | 416 | 1 | 3 |
| α-helix | 419-421 | 3 | |
| β-strand | 422-430 | 9 | 3 |
| β-strand | 435-441 | 7 | 3 |
| β-strand | 449-455 | 7 | 3 |
| α-helix | 462-476 | 15 | |
| β-strand | 483 | 1 | 4 |
| α-helix | 484-485 | 2 | |
| β-strand | 486-490 | 5 | 3 |
| α-helix | 495 | 1 | |
| β-strand | 496-500 | 5 | 3 |
| β-strand | 505-506 | 2 | 4 |
| α-helix | 507-513 | 7 | |
| α-helix | 520-539 | 20 | |
| α-helix | 549-551 | 3 | |
| β-strand | 552-556 | 5 | 4 |
| β-strand | 559-562 | 4 | 4 |
| α-helix | 586-588 | 3 | |
| α-helix | 591-596 | 6 | |
| α-helix | 601-616 | 16 | |
| α-helix | 620-621 | 2 | |
| α-helix | 628-636 | 9 | |
| α-helix | 641-644 | 4 | |
| α-helix | 649-658 | 10 | |
| α-helix | 663-665 | 3 | |
| α-helix | 667-668 | 2 | |
| α-helix | 669-686 | 18 |
| Molecule | Chains | Type | Length | Organism | UniProt |
|---|---|---|---|---|---|
| PTK2 protein | A, B | protein | 282 | Homo sapiens | Q05397 (AlphaFold model) |
>3PXK_1 PTK2 protein (chains A, B) GSGSTRDYEIQRERIELGRCIGEGQFGDVHQGIYMSPENPALAVAIKTCKNCTSDSVREK FLQEALTMRQFDHPHIVKLIGVITENPVWIIMELCTLGELRSFLQVRKYSLDLASLILYA YQLSTALAYLESKRFVHRDIAARNVLVSSNDCVKLGDFGLSRYMEDSTYYKASKGKLPIK WMAPESINFRRFTSASDVWMFGVCMWEILMHGVKPFQGVKNNDVIGRIENGERLPMPPNC PPTLYSLMTKCWAYDPSRRPRFTELKAQLSTILEEEKAQQEE
| ID | Name | Formula | Copies |
|---|---|---|---|
| PXK | 6-(4,4-dimethylpent-2-ynyl)-4~{H}-pyrrolo[2,3-d][1,3]thiazole | C12 H14 N2 S | 2 |
Water and common crystallization additives (SO4) are not listed.
Co-crystal Structures of FAK with an Unprecedented Pyrrolo[2,3-d]thiazole. Koolman, H., Heinrich, T., Musil, D. To be published.
Other PDB entries of the same protein (UniProt Q05397 (AlphaFold model), which also has an AlphaFold model), best resolution first:
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