6Q9L
HDM2 (17-111, WILDTYPE) COMPLEXED WITH COMPOUND 9 AT 1.13A; Structural states of Hdm2 and HdmX: X-ray elucidation of adaptations and binding interactions for different chemical compound classes
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-12 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97848 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 56.773, 87.407, 37.141 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.130 |
R-factor | 0.1788 |
Rwork | 0.178 |
R-free | 0.18980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4dij |
RMSD bond length | 0.013 |
RMSD bond angle | 1.585 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.170 |
High resolution limit [Å] | 1.130 | 1.130 |
Rmerge | 0.065 | 0.178 |
Number of reflections | 63421 | 6856 |
<I/σ(I)> | 12.1 | 3.05 |
Completeness [%] | 91.2 | 70.5 |
Redundancy | 5.6 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 2.7M AmSO4, 0.2M NaI, 0.2M NaCl, 0.2M TRIS |