9MKC
Crystal structure of MALT1 in complex with an allosteric inhibitor
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-09-12 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.660, 77.151, 92.470 |
| Unit cell angles | 90.00, 93.59, 90.00 |
Refinement procedure
| Resolution | 34.100 - 2.800 |
| Rwork | 0.281 |
| R-free | 0.30500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.4) |
| Refinement software | PRIME-X |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.490 | 2.830 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.090 | 0.585 |
| Rmeas | 0.110 | 0.690 |
| Rpim | 0.057 | 0.371 |
| Number of reflections | 28223 | 3689 |
| <I/σ(I)> | 7.5 | 1.9 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 3.4 | 3.4 |
| CC(1/2) | 0.994 | 0.803 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.10M sodium hepes, 0.40 M calcium chloride, 20% (v/v) PEG 400 |
