2QBR
Crystal structure of ptp1b-inhibitor complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.1 |
Synchrotron site | ALS |
Beamline | 5.0.1 |
Temperature [K] | 113 |
Detector technology | CCD |
Collection date | 2002-04-02 |
Detector | ADSC QUANTUM 210 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 88.946, 88.946, 104.826 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.300 |
R-factor | 0.2 |
Rwork | 0.200 |
R-free | 0.23100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.340 |
High resolution limit [Å] | 2.300 | 2.300 |
Number of reflections | 20583 | |
Completeness [%] | 94.6 | 94 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 17% PEG 4000, 0.15M MGCL2, 0.1M HEPES, PH 7.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 278K, pH 7.00 |