4JM5
Crystal structure of Cytochrome C Peroxidase W191G-Gateless in complex with 2-Amino-5-methylthiazole
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2010-10-20 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.314, 74.941, 106.643 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.260 - 1.260 |
R-factor | 0.129 |
Rwork | 0.128 |
R-free | 0.15470 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 1.826 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 61.310 |
High resolution limit [Å] | 1.260 |
Number of reflections | 108085 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 283 | Co-crystal grown in 500mM MES, pH 6.0 and 25mM 2-amino-5-methylthiazole, VAPOR DIFFUSION, SITTING DROP, temperature 283K |