3BT8
Crystal Structure of Mutant Cyclophilin (R147A) from Leishmania donovani
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 293 |
Detector technology | IMAGE PLATE |
Collection date | 2007-09-01 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 65 |
Unit cell lengths | 74.973, 74.973, 61.323 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 17.300 - 2.700 |
Rwork | 0.158 |
R-free | 0.22600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2haq |
RMSD bond length | 0.008 |
RMSD bond angle | 1.300 |
Data reduction software | AUTOMAR |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.750 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.050 | 0.152 |
Number of reflections | 5450 | |
<I/σ(I)> | 11 | 4.2 |
Completeness [%] | 99.5 | 99.3 |
Redundancy | 6.15 | 6.17 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 292 | 0.01M TRIS, 10.0% PEG 3350, 0.02% AZIDE, PH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 292K |