Data DOI: 10.15785/SBGRID/846 | ID: 846
Publication DOI: 10.1039/D1CC04742F
7PHX Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB
Pereira Laboratory, IBMC/i3S, Universidade do Porto
Release Date: 28 Sep 2021
1. If this dataset is locally available, it should be accessable at /programs/datagrid/846
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/846 .' (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/846 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/846 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/846 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 846 ; shasum -c files.sha'
Storage requirements: 5.3G
Biological Sample:
Human thrombin:tsetse thrombin inhibitor complex
Dataset Type:
X-Ray Diffraction
Subject Composition:
Protein
Collection Facility:
ALBA BL13 XALOC
Data Creation Date:
25 Jan 2018
Related Datasets:
None
Calisto, BM; Pereira, PJB. 2021. "X-Ray Diffraction data for: Human thrombin:tsetse thrombin inhibitor complex. PDB Code 7PHX", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/846.
Human thrombin:tsetse thrombin inhibitor complex, source of 7PHX 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 - 0.97926
Sweep:
SWEEP1
Files:
/programs/datagrid/846/TB-TTI1_G_2_####.cbf
Images:
251 - 1150
Beam:
(225.02, 211.95) -> (225.02, 211.93)
Distance:
317.09 -> 316.3
Spacegroup:
P 2 2 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.7 | 4.61 | 1.7 |
| Low resolution limit | 24.7 | 24.7 | 1.73 |
| Completeness | 91.2 | 89.7 | 86.1 |
| Multiplicity | 3.2 | 3.3 | 3.2 |
| I/sigma | 4.2 | 11.8 | 0.4 |
| Rmerge | 0.068 | 0.028 | 2.117 |
| CC half | 0.998 | 0.998 | 0.342 |
| Anomalous completeness | 77.8 | 76.5 | 70.3 |
| Anomalous multiplicity | 1.8 | 1.8 | 1.8 |
| Cell | 80.75 | 87.32 | 171.72 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Reprocessing failed.
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97926
Sweep:
SWEEP1
Files:
/programs/datagrid/846/TB-TTI1_G_2_####.cbf
Images:
251 - 1150
Beam:
(225.02, 211.95) -> (225.02, 211.96)
Distance:
317.09 -> 317.61
Spacegroup:
C 2 2 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.65 | 4.46 | 1.65 |
| Low resolution limit | 32.42 | 32.42 | 1.67 |
| Completeness | 95.2 | 91.9 | 73.2 |
| Multiplicity | 3.4 | 3.4 | 3.4 |
| I/sigma | 5.5 | 34.1 | 0.1 |
| Rmerge | 0.07 | 0.037 | 2.282 |
| CC half | 0.99 | 0.985 | 0.58 |
| Anomalous completeness | 87.5 | 85.9 | 67.4 |
| Anomalous multiplicity | 1.8 | 1.8 | 1.8 |
| Cell | 93.238 | 172.862 | 81.355 | 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.
