3QFV
MRCK beta in complex with TPCA-1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.810, 123.360, 85.490 |
| Unit cell angles | 90.00, 100.69, 90.00 |
Refinement procedure
| Resolution | 39.970 - 2.650 |
| R-factor | 0.19599 |
| Rwork | 0.192 |
| R-free | 0.26757 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | MRCK beta in complex with Fasudil |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.609 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 44.030 |
| High resolution limit [Å] | 2.630 |
| Number of reflections | 25154 |
| Completeness [%] | 100.0 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 277 | pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
