2F67
Crystal structure of Nucleoside 2-deoxyribosyltransferase from Trypanosoma brucei at 1.6 A resolution with BENZO[CD]INDOL-2(1H)-ONE bound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.2 |
| Synchrotron site | ALS |
| Beamline | 8.2.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-04-06 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 58.928, 75.513, 86.336 |
| Unit cell angles | 90.00, 90.01, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.600 |
| R-factor | 0.17926 |
| Rwork | 0.178 |
| R-free | 0.20777 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2a0k |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.026 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.686 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Number of reflections | 42601 | |
| <I/σ(I)> | 7.8 | 2.5 |
| Completeness [%] | 89.9 | 55.95 |
| Redundancy | 3.5 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 277 | 30 % PEG MME 2000, 0.2 ammonium sulfate, 0.1 sodium acetate trihydrate pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
