8H7I
Structure of nanobody 11A in complex with quinalphos
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-11-01 |
| Detector | DECTRIS EIGER2 S 9M |
| Wavelength(s) | 0.979176 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 68.113, 96.123, 91.121 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.060 - 2.400 |
| R-factor | 0.196 |
| Rwork | 0.194 |
| R-free | 0.23530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4wen |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.570 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.158 | 0.590 |
| Number of reflections | 11968 | 1229 |
| <I/σ(I)> | 8.7 | 2.9 |
| Completeness [%] | 99.6 | 99.9 |
| Redundancy | 7.9 | 7.6 |
| CC(1/2) | 0.991 | 0.882 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 293.15 | 0.1 M citric acid, pH 4.0, 5% w/v PEG6000 |
