3O1X
High resolution crystal structure of histidine triad nucleotide-binding protein 1 (Hint1) C84A mutant from rabbit complexed with adenosine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-2 |
Synchrotron site | MAX II |
Beamline | I911-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-11-19 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0379 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 39.765, 39.765, 141.410 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.050 - 1.080 |
R-factor | 0.14296 |
Rwork | 0.141 |
R-free | 0.17139 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3LLJ |
RMSD bond length | 0.025 |
RMSD bond angle | 2.272 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP (10.2.31) |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.100 |
High resolution limit [Å] | 1.080 | 1.080 |
Rmerge | 0.110 | 0.628 |
Number of reflections | 49845 | |
<I/σ(I)> | 16.15 | 2.88 |
Completeness [%] | 99.6 | 99.7 |
Redundancy | 10.7 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 281 | 30% PEG 8000, 0.1M sodium cacodylate pH 6.5, O.1M sodium acetate, protein concentration 10 mg/ml, VAPOR DIFFUSION, HANGING DROP, temperature 281K |