6NLH
Structure of human triose phosphate isomerase R189A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2018-10-08 |
Detector | RIGAKU RAXIS HTC |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 |
Unit cell lengths | 65.142, 73.661, 92.842 |
Unit cell angles | 90.03, 90.03, 90.00 |
Refinement procedure
Resolution | 19.665 - 2.199 |
R-factor | 0.1744 |
Rwork | 0.174 |
R-free | 0.21570 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4poc |
Data reduction software | DENZO |
Data scaling software | HKL-2000 |
Phasing software | PHASER (2.8.2) |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.240 |
High resolution limit [Å] | 2.199 | 5.970 | 2.200 |
Rmerge | 0.081 | 0.025 | 0.414 |
Rmeas | 0.104 | 0.032 | 0.532 |
Rpim | 0.064 | 0.020 | 0.330 |
Number of reflections | 84136 | 4270 | 4170 |
<I/σ(I)> | 12.5 | ||
Completeness [%] | 96.0 | 97.6 | 93.8 |
Redundancy | 2.5 | 2.4 | 2.5 |
CC(1/2) | 0.999 | 0.752 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 31% PEG 3350, 50 mM Potassium Bromide, Tris pH7.5 |