Download MendeleyPanDDA analysis group deposition
Schuller, M., Talon, R., Krojer, T., Brandao-Neto, J., Douangamath, A., Zhang, R., von Delft, F., Schuler, H., Kessler, B., Knapp, S., Bountra, C., Arrowsmith, C.H., Edwards, A., Elkins, J.To be published.
5QHV
PanDDA analysis group deposition -- Crystal Structure of human PARP14 Macrodomain 3 in complex with FMOPL000299a
- PDB DOI: https://doi.org/10.2210/pdb5QHV/pdb
- Deposition Group: G_1002047 (changed state) ExploreG_1002047
- Classification: TRANSFERASE
- Organism(s): Homo sapiens
- Expression System: Escherichia coli
- Mutation(s): No
- Deposited: 2018-05-21 Released: 2019-04-10
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 1.05 Å
- R-Value Free: 0.218 (Depositor), 0.240 (DCC)
- R-Value Work: 0.203 (Depositor), 0.230 (DCC)
- R-Value Observed: 0.204 (Depositor)
This is version 1.1 of the entry. See complete history.
Literature
To be published.
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| Poly [ADP-ribose] polymerase 14 | 183 | Homo sapiens | Mutation(s): 0 Gene Names: PARP14, BAL2, KIAA1268 EC: 2.4.2.30 (PDB Primary Data), 2.4.2 (UniProt) |  | |
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for Q460N5 (Homo sapiens) Explore Q460N5 Go to UniProtKB: Q460N5 | |||||
PHAROS: Q460N5 GTEx: ENSG00000173193 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | Q460N5 | ||||
Sequence AnnotationsExpand | |||||
| |||||
Small Molecules
| Ligands 3 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| AWP Query on AWP | E [auth A] | 1-cyclohexyl-3-(2-pyridin-4-ylethyl)urea C14 H21 N3 O XUPGANVQJLTRNJ-UHFFFAOYSA-N |  | ||
| DMS Query on DMS | D [auth A] | DIMETHYL SULFOXIDE C2 H6 O S IAZDPXIOMUYVGZ-UHFFFAOYSA-N |  | ||
| CL Query on CL | B [auth A], C [auth A] | CHLORIDE ION Cl VEXZGXHMUGYJMC-UHFFFAOYSA-M |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 1.05 Å
- R-Value Free: 0.218 (Depositor), 0.240 (DCC)
- R-Value Work: 0.203 (Depositor), 0.230 (DCC)
- R-Value Observed: 0.204 (Depositor)
Space Group: P 21 21 21
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 34.076 | α = 90 |
| b = 41.697 | β = 90 |
| c = 110.967 | γ = 90 |
| Software Name | Purpose |
|---|---|
| REFMAC | refinement |
| Aimless | data scaling |
| PDB_EXTRACT | data extraction |
| XDS | data reduction |
| REFMAC | phasing |
Entry History
Deposition Data
- Released Date: 2019-04-10 Deposition Author(s): Schuller, M., Talon, R., Krojer, T., Brandao-Neto, J., Douangamath, A., Zhang, R., von Delft, F., Schuler, H., Kessler, B., Knapp, S., Bountra, C., Arrowsmith, C.H., Edwards, A., Elkins, J.
Revision History (Full details and data files)
- Version 1.0: 2019-04-10
Type: Initial release - Version 1.1: 2024-03-06
Changes: Data collection, Database references
