Data DOI: 10.15785/SBGRID/737 | ID: 737
Publication DOI: 10.1016/j.chembiol.2020.10.002
6TKG 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/737
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/737 .' (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/737 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/737 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/737 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 737 ; shasum -c files.sha'
Storage requirements: 5.8G
Biological Sample:
Human thrombin:tsetse thrombin inhibitor complex
Dataset Type:
X-Ray Diffraction
Subject Composition:
Protein
Collection Facility:
ALBA BL13 XALOC
Data Creation Date:
20 Oct 2017
Related Datasets:
None
Calisto, BM; Pereira, PJB. 2020. "X-Ray Diffraction data for: Human thrombin:tsetse thrombin inhibitor complex. PDB Code 6TKG", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/737.
X-Ray Diffraction data from human thrombin:sulfated TTI complex, source of 6TKG 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 - 1.03324
Sweep:
SWEEP1
Files:
/programs/datagrid/737/TB_TTI0_B_2_####.cbf
Images:
1 - 1000
Beam:
(224.95, 212.35) -> (224.95, 212.34)
Distance:
196.64 -> 196.49
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.3 | 3.53 | 1.3 |
| Low resolution limit | 37.83 | 37.85 | 1.32 |
| Completeness | 98.4 | 99.7 | 96.5 |
| Multiplicity | 5.4 | 5.1 | 5.5 |
| I/sigma | 9.2 | 38.8 | 0.4 |
| Rmerge | 0.069 | 0.026 | 2.71 |
| CC half | 0.999 | 0.999 | 0.362 |
| Anomalous completeness | 96.5 | 96.9 | 94.2 |
| Anomalous multiplicity | 2.9 | 2.9 | 2.9 |
| Cell | 46.42 | 81.12 | 85.53 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.03324
Sweep:
SWEEP1
Files:
/programs/datagrid/737/TB_TTI0_B_2_####.cbf
Images:
1 - 1000
Beam:
(224.95, 212.35) -> (224.95, 212.35)
Distance:
196.64 -> 196.46
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.3 | 3.53 | 1.3 |
| Low resolution limit | 46.42 | 46.45 | 1.32 |
| Completeness | 98.4 | 99.7 | 96.7 |
| Multiplicity | 5.4 | 5.1 | 5.5 |
| I/sigma | 9.2 | 38.9 | 0.4 |
| Rmerge | 0.069 | 0.025 | 2.706 |
| CC half | 0.999 | 0.999 | 0.375 |
| Anomalous completeness | 96.5 | 96.9 | 94.7 |
| Anomalous multiplicity | 2.9 | 2.9 | 2.9 |
| Cell | 46.42 | 81.12 | 85.53 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.03324
Sweep:
SWEEP1
Files:
/programs/datagrid/737/TB_TTI0_B_2_####.cbf
Images:
1 - 1000
Beam:
(224.95, 212.35) -> (224.95, 212.35)
Distance:
196.64 -> 196.71
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.27 | 3.44 | 1.27 |
| Low resolution limit | 58.83 | 58.89 | 1.29 |
| Completeness | 98.4 | 100.0 | 95.3 |
| Multiplicity | 5.4 | 5.2 | 4.8 |
| I/sigma | 8.5 | 58.7 | 0.2 |
| Rmerge | 0.079 | 0.032 | 2.154 |
| CC half | 0.997 | 0.995 | 0.34 |
| Anomalous completeness | 97.3 | 99.8 | 93.1 |
| Anomalous multiplicity | 2.8 | 2.8 | 2.8 |
| Cell | 46.392 | 81.085 | 85.476 | 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.
