PDB-code
| Kinase structure | |
| Kinase: | PI4KA |
| Family: | PIK |
| Group: | Atypical |
| Species: | HUMAN |
| IUPHAR/BPS ID: | 2148 |
| PDB: | 6BQ1 |
| sc-PDB: | |
| KIDFamMap: | Search |
| Release date: | 2017-12-13 |
| PubMed: | 29229838 |
| Chain: | E |
| Orthosteric ligand: | E4S |
 | |
| More entries for 6BQ1 | |||
| 6BQ1 | Chain: | A | |
| Structural information | |
| DFG conformation: | out-like |
| αC-helix conformation: | in |
| G-rich loop angle (distance): | 58.6° (18.2Å) |
| G-rich loop rotation: | 136.5° |
| Quality Score: | 6.8 |
| Resolution: | NMR |
| Missing Residues: | 2 |
| Missing Atoms: | 0 |
| Ligand binding mode | ||||
| Pockets | Subpockets | |||
| front gate | BP-I-A BP-I-B | |||
| Pocket alignment | |
| Uniprot sequence: | TPMQSAAKAPYLAAIFKVGDCRQDMLALQIIDLFVFPYRVVCGVIECIPCTSRDQLGRQLLFL--LQIKDRHNGNIMLHIDFGFM |
| Sequence structure: | _PMQSAAKAPYLAAIFKVGDCRQDMLALQIIDLFVFPYRVVCGVIECIPDCTSRDQLG_LLFL__LQIKDRHNGNIMLHIDFGFM |
| Ligand affinity | |
| Ligand not found in ChEMBL. | |
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 _ _ | 2 P 1794 | 3 M 1795 | 4 Q 1796 | 5 S 1797 | 6 A 1798 | 7 A 1799 | 8 K 1800 | 9 A 1801 | 10 P 1802 | 11 Y 1803 | 12 L 1804 | 13 A 1805 | 14 A 1847 | 15 I 1848 | 16 F 1849 | 17 K 1850 | 18 V 1851 | 19 G 1852 | 20 D 1854 |
| • | • | • | • | ||||||||||||||||
| αC | b.l | IV | |||||||||||||||||
| 21 C 1855 | 22 R 1856 | 23 Q 1857 | 24 D 1858 | 25 M 1859 | 26 L 1860 | 27 A 1861 | 28 L 1862 | 29 Q 1863 | 30 I 1864 | 31 I 1865 | 32 D 1866 | 33 L 1879 | 34 F 1880 | 35 V 1881 | 36 F 1882 | 37 P 1883 | 38 Y 1884 | 39 R 1885 | 40 V 1886 |
| •• | |||||||||||||||||||
| IV | V | GK | hinge | linker | αD | αE | |||||||||||||
| 41 V 1887 | 42 C 1893 | 43 G 1894 | 44 V 1895 | 45 I 1896 | 46 E 1897 | 47 C 1898 | 48 I 1899 | 49 P 1900 | 50 D 1901 | 51 C 1902 | 52 T 1903 | 53 S 1904 | 54 R 1905 | 55 D 1906 | 56 Q 1907 | 57 L 1908 | 58 G 1915 | 59 _ _ | 60 L 1949 |
| • | • | • | ••• | • | • | ||||||||||||||
| αE | VI | c.l | VII | VIII | x | ||||||||||||||
| 61 L 1950 | 62 F 1951 | 63 L 1952 | 64 _ _ | 65 _ _ | 66 L 1953 | 67 Q 1954 | 68 I 1955 | 69 K 1956 | 70 D 1957 | 71 R 1958 | 72 H 1959 | 73 N 1960 | 74 G 1961 | 75 N 1962 | 76 I 1963 | 77 M 1964 | 78 L 1965 | 79 H 1973 | 80 I 1974 |
| • | • | • | |||||||||||||||||
| DFG | a.l | ||||||||||||||||||
| 81 D 1975 | 82 F 1976 | 83 G 1977 | 84 F 1978 | 85 M 1979 | |||||||||||||||
Interaction pattern search
Search KLIFS for kinase-ligand complexes with similar interaction patterns:
