2ZGJ
Crystal Structure of D86N-GzmM Complexed with Its Optimal Synthesized Substrate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 93 |
Detector technology | IMAGE PLATE |
Collection date | 2007-11-15 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 74.487, 74.487, 112.689 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 26.450 - 2.300 |
R-factor | 0.24226 |
Rwork | 0.240 |
R-free | 0.28779 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2zgc |
RMSD bond length | 0.019 |
RMSD bond angle | 1.859 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.350 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.051 | 0.399 |
Number of reflections | 16608 | |
<I/σ(I)> | 36.1 | 3.38 |
Completeness [%] | 99.4 | 99.4 |
Redundancy | 5.8 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 289 | 0.1M Bicine, 0.2M Li2SO4, 21% PEG3350, pH8.0, VAPOR DIFFUSION, HANGING DROP, temperature 289K |