1UNJ
Crystal structure of a 7-Aminoactinomycin D complex with non-complementary DNA
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE BW7A |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | BW7A |
| Temperature [K] | 100 |
| Collection date | 2002-07-15 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.9050,0.9196,0.9204 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 71.222, 71.222, 108.400 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 2.500 |
| R-factor | 0.276 |
| R-free | 0.31630 |
| Structure solution method | MAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.015 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELXD |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.080 | 0.480 |
| Number of reflections | 11527 | |
| <I/σ(I)> | 6.57 | 5.27 |
| Completeness [%] | 99.0 | 93.3 |
| Redundancy | 10.15 | 9.37 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | NA.CITRATE PH 5.6, NA.ACETATE,(NH4)2SO4,HANGING DROP,T 293K |
