4ZP5
MAP4K4 in complex with inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-03-10 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 80.633, 91.386, 97.528 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 66.690 - 2.290 |
R-factor | 0.2309 |
Rwork | 0.229 |
R-free | 0.26410 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.090 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | BUSTER |
Refinement software | BUSTER (2.9.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 97.530 | 2.410 |
High resolution limit [Å] | 2.290 | 2.290 |
Rmerge | 0.053 | 0.465 |
Number of reflections | 31533 | |
<I/σ(I)> | 21.3 | 2.2 |
Completeness [%] | 94.8 | 67.1 |
Redundancy | 6.6 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | PEG 3350 |