7ALQ
human GCH-GFRP inhibitory complex 7-deaza-GTP bound
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 | 2019-03-21 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.99988 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 106.104, 185.418, 184.231 |
Unit cell angles | 90.00, 97.94, 90.00 |
Refinement procedure
Resolution | 182.470 - 2.205 |
R-factor | 0.1795 |
Rwork | 0.177 |
R-free | 0.22190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wpl |
RMSD bond length | 0.009 |
RMSD bond angle | 1.090 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.7 (18-SEP-2020)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 182.470 | 2.464 |
High resolution limit [Å] | 2.205 | 2.205 |
Rmerge | 0.113 | 0.902 |
Number of reflections | 223947 | 11196 |
<I/σ(I)> | 9.3 | 1.6 |
Completeness [%] | 93.9 | 69 |
Redundancy | 3.5 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293.15 | 0.2 M Sodium malonate pH 7.0; 20% w/v PEG3350 (Index H03) |