4FPW
Crystal Structure of CalU16 from Micromonospora echinospora. Northeast Structural Genomics Consortium Target MiR12.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-04-12 |
Detector | ADSC QUANTUM 4r |
Wavelength(s) | 0.979 |
Spacegroup name | P 61 |
Unit cell lengths | 51.852, 51.852, 305.705 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.910 - 2.500 |
R-factor | 0.24263 |
Rwork | 0.241 |
R-free | 0.28163 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.453 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXS |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.540 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.063 | 0.225 |
Number of reflections | 21977 | |
<I/σ(I)> | 13.7 | |
Completeness [%] | 94.2 | 99.4 |
Redundancy | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Microbatch under oil | 7 | 291 | 2.9 M Sodium malonate pH 7, Microbatch under oil, temperature 291K |
1 | Microbatch under oil | 7 | 291 | 2.9 M Sodium malonate pH 7, Microbatch under oil, temperature 291K |