6JBP
Structure of MP-4 from Mucuna pruriens at 2.22 Angstroms
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | Xenocs GeniX 3D Cu HF |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 2017-11-01 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 75.460, 75.460, 94.230 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.218 - 2.217 |
R-factor | 0.1814 |
Rwork | 0.179 |
R-free | 0.22030 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5dss |
RMSD bond length | 0.006 |
RMSD bond angle | 0.773 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.700 | 2.330 |
High resolution limit [Å] | 2.210 | 2.210 |
Rmerge | 0.067 | 0.322 |
Rmeas | 0.072 | 0.348 |
Rpim | 0.026 | 0.129 |
Number of reflections | 15843 | 2151 |
<I/σ(I)> | 23.8 | 5.9 |
Completeness [%] | 99.2 | 94.2 |
Redundancy | 7.3 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 298 | 50mM Tris-HCl pH 9.5, 1.5M ammonium sulfate |