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 |
