4J7D
The 1.25A crystal structure of humanized Xenopus MDM2 with a nutlin fragment, RO5045331
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2012-09-22 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 31.639, 38.158, 69.027 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.510 - 1.250 |
R-factor | 0.194 |
Rwork | 0.192 |
R-free | 0.22400 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 1.000 |
Data reduction software | HKL-3000 |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | CNX (2005) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.000 | 40.000 | 1.240 |
High resolution limit [Å] | 1.170 | 3.710 | 1.170 |
Rmerge | 0.044 | 0.028 | 0.471 |
Number of reflections | 27483 | ||
<I/σ(I)> | 9.9 | 21.7 | 2 |
Completeness [%] | 98.2 | 99.5 | 90.1 |
Redundancy | 6.1 | 5.5 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 278 | 40-50% SATURATED AMMONIUM SULFATE, 0.1M MES, PH 6.5, 5% PEG200, VAPOR DIFFUSION, HANGING DROP, temperature 278K |