5YFW
Crystal structure of ribose-1,5-bisphosphate isomerase mutant D204N from Pyrococcus horikoshii OT3 in complex with ribose-1,5-bisphosphate and AMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-12-03 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 1 2 |
Unit cell lengths | 98.700, 98.700, 256.551 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 85.520 - 2.350 |
R-factor | 0.1587 |
Rwork | 0.156 |
R-free | 0.21270 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5yfj |
RMSD bond length | 0.017 |
RMSD bond angle | 1.900 |
Data scaling software | Aimless (0.5.28) |
Phasing software | PHASER (2.6.1) |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 85.520 | 2.410 | |
High resolution limit [Å] | 2.350 | 2.350 | |
Rmerge | 0.109 | 0.487 | 0.032 |
Rmeas | 0.115 | 0.513 | 0.035 |
Rpim | 0.035 | 0.159 | 0.012 |
Number of reflections | 60020 | 4384 | 751 |
<I/σ(I)> | 16.3 | 5.1 | |
Completeness [%] | 100.0 | 100 | 99.9 |
Redundancy | 10.4 | 10.3 | 9.5 |
CC(1/2) | 0.998 | 0.954 | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.7 M NaCl, 3% PEG 6000, 20% MPD |