Data DOI: 10.15785/SBGRID/739 | ID: 739
Publication DOI: 10.1016/j.chembiol.2020.10.002
6TKI Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB
Pereira Laboratory, IBMC/i3S, Universidade do Porto
Release Date: 27 Oct 2020
1. If this dataset is locally available, it should be accessable at /programs/datagrid/739
2. To download this dataset, please run the following command from your Terminal on a Linux or OS X workstation:
'rsync -av rsync://data.sbgrid.org/10.15785/SBGRID/739 .' (Harvard Medical School, USA)
Depending on your location, faster access may be available from a Tier 1 site closer to your location
'rsync -av rsync://sbgrid.icm.uu.se/10.15785/SBGRID/739 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/739 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/739 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 739 ; shasum -c files.sha'
Storage requirements: 11G
Biological Sample:
Human thrombin:tsetse thrombin inhibitor complex
Dataset Type:
X-Ray Diffraction
Subject Composition:
Protein
Collection Facility:
ESRF ID29
Data Creation Date:
15 May 2014
Related Datasets:
None
Calisto, BM; Pereira, PJB. 2020. "X-Ray Diffraction data for: Human thrombin:tsetse thrombin inhibitor complex. PDB Code 6TKI", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/739.
X-Ray Diffraction data from human thrombin:sulfated TTI complex, source of 6TKI structure
| Name | Additional Roles | Affiliation While Working on the Project |
|---|---|---|
| Pedro JB Pereira | Depositor | IBMC - Instituto de Biologia Molecular e Celular |
| Barbara M Calisto | Data Collector | ALBA Synchrotron |
| Pedro Pereira | PI | Universidade do Porto |
none
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97625
Sweep:
SWEEP1
Files:
/programs/datagrid/739/TB8_w1_1_####.cbf
Images:
1 - 1800
Beam:
(216.11, 211.76) -> (216.11, 211.64)
Distance:
339.0 -> 341.1
Spacegroup:
P 41 21 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.71 | 4.64 | 1.71 |
| Low resolution limit | 39.82 | 39.84 | 1.74 |
| Completeness | 100.0 | 100.0 | 100.0 |
| Multiplicity | 12.9 | 11.9 | 10.2 |
| I/sigma | 15.1 | 56.3 | 0.5 |
| Rmerge | 0.075 | 0.032 | 4.218 |
| CC half | 0.999 | 0.999 | 0.267 |
| Anomalous completeness | 99.9 | 99.9 | 99.8 |
| Anomalous multiplicity | 6.8 | 6.8 | 6.8 |
| Cell | 112.64 | 112.64 | 60.21 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97625
Sweep:
SWEEP1
Files:
/programs/datagrid/739/TB8_w1_1_####.cbf
Images:
1 - 1800
Beam:
(216.11, 211.76) -> (216.11, 211.65)
Distance:
339.0 -> 342.04
Spacegroup:
P 41 21 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.71 | 4.64 | 1.71 |
| Low resolution limit | 60.21 | 60.25 | 1.74 |
| Completeness | 100.0 | 100.0 | 100.0 |
| Multiplicity | 12.9 | 11.9 | 10.2 |
| I/sigma | 15.1 | 56.2 | 0.5 |
| Rmerge | 0.075 | 0.032 | 4.218 |
| CC half | 0.999 | 0.999 | 0.274 |
| Anomalous completeness | 99.9 | 99.9 | 99.8 |
| Anomalous multiplicity | 6.8 | 6.8 | 6.8 |
| Cell | 112.65 | 112.65 | 60.21 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97625
Sweep:
SWEEP1
Files:
/programs/datagrid/739/TB8_w1_1_####.cbf
Images:
1 - 1800
Beam:
(216.11, 211.76) -> (216.11, 211.63)
Distance:
339.0 -> 342.05
Spacegroup:
P 41 21 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.67 | 4.54 | 1.67 |
| Low resolution limit | 79.67 | 79.76 | 1.7 |
| Completeness | 99.9 | 100.0 | 96.5 |
| Multiplicity | 12.5 | 12.0 | 8.3 |
| I/sigma | 9.9 | 66.0 | 0.1 |
| Rmerge | 0.083 | 0.033 | 4.683 |
| CC half | 0.999 | 0.999 | 0.323 |
| Anomalous completeness | 99.7 | 99.9 | 95.5 |
| Anomalous multiplicity | 6.6 | 6.6 | 6.6 |
| Cell | 112.674 | 112.674 | 60.266 | 90.0 | 90.0 | 90.0 |
|---|
License: CC0
Terms: Our Community Norms as well as good scientific practices expect that proper credit is given via citation. Please use the data citation, as generated by the SBGrid Data Bank.
