8G3W
MBP-Mcl1 in complex with ligand 28
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-09-09 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 99.498, 137.411, 38.592 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 80.590 - 1.780 |
R-factor | 0.18685 |
Rwork | 0.185 |
R-free | 0.22587 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 1.368 |
Data reduction software | autoPROC (1.1.7) |
Data scaling software | Aimless (0.7.7) |
Phasing software | PHASER (7.1.015) |
Refinement software | REFMAC (7.1.015) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.590 | 1.810 |
High resolution limit [Å] | 1.780 | 1.780 |
Rmeas | 0.065 | 1.580 |
Rpim | 0.022 | 0.551 |
Number of reflections | 51740 | 2528 |
<I/σ(I)> | 17.5 | 1.3 |
Completeness [%] | 99.9 | 99.7 |
Redundancy | 8.2 | 7.9 |
CC(1/2) | 1.000 | 0.787 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 285 | 19% (w/v) PEG3350, 0.05 M Mg Formate |