6KR5
Crystal structure of O-Acetyl Serine Sulfhydrylase isoform 3 from Entamoeba histolytica
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 193.15 |
Detector technology | CCD |
Collection date | 2016-02-06 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 80.505, 85.874, 91.164 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.366 - 1.544 |
R-factor | 0.1809 |
Rwork | 0.180 |
R-free | 0.21470 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2pqm |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (dev_3352) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.580 |
High resolution limit [Å] | 1.540 | 1.550 |
Rmeas | 0.074 | 0.920 |
Rpim | 0.270 | |
Number of reflections | 92112 | 4544 |
<I/σ(I)> | 44 | 2 |
Completeness [%] | 99.5 | 100 |
Redundancy | 7.3 | 7 |
CC(1/2) | 0.830 | 0.830 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 289.15 | 0.1M PCTP buffer, 25% PEG 1500 |