3TZM
TGF-beta Receptor type 1 in complex with SB431542
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-06-29 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97949 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 41.771, 77.726, 90.070 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.450 - 1.700 |
R-factor | 0.17214 |
Rwork | 0.170 |
R-free | 0.20501 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1py5 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.232 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 31955 | |
<I/σ(I)> | 5.4 | |
Completeness [%] | 96.8 | 99.8 |
Redundancy | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 100 mM Imidazole 10% PEG 8000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |