Download MendeleyPARP15 catalytic domain in complex with Niraparib
Zhou, X.L., Zhou, H., Li, J., Zhang, J.To be published.
7F43
PARP15 catalytic domain in complex with Niraparib
- PDB DOI: https://doi.org/10.2210/pdb7F43/pdb
- Classification: TRANSFERASE
- Organism(s): Homo sapiens
- Expression System: Escherichia coli BL21(DE3)
- Mutation(s): No
- Deposited: 2021-06-17 Released: 2022-06-22
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 1.62 ?
- R-Value Free: 0.275
- R-Value Work: 0.240
- R-Value Observed: 0.242
Starting Model: experimental
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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 |
| Protein mono-ADP-ribosyltransferase PARP15 | 200 | Homo sapiens | Mutation(s): 0 Gene Names: PARP15, BAL3 EC: 2.4.2 |  | |
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for Q460N3 (Homo sapiens) Explore Q460N3 Go to UniProtKB: Q460N3 | |||||
PHAROS: Q460N3 GTEx: ENSG00000173200 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | Q460N3 | ||||
Sequence AnnotationsExpand | |||||
| |||||
Small Molecules
| Ligands 1 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| 3JD (Subject of Investigation/LOI) Query on 3JD | C [auth B] | 2-{4-[(3S)-piperidin-3-yl]phenyl}-2H-indazole-7-carboxamide C19 H20 N4 O PCHKPVIQAHNQLW-CQSZACIVSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 1.62 ?
- R-Value Free: 0.275
- R-Value Work: 0.240
- R-Value Observed: 0.242
- Space Group: P 21 21 21
Unit Cell:
| Length ( ? ) | Angle ( ? ) |
|---|---|
| a = 45.515 | ¦Á = 90 |
| b = 68.726 | ¦Â = 90 |
| c = 160.631 | ¦Ă = 90 |
| Software Name | Purpose |
|---|---|
| PHENIX | refinement |
| XDS | data reduction |
| XDS | data scaling |
| PHENIX | phasing |
Entry History
Deposition Data
- Released Date: 2022-06-22 Deposition Author(s): Zhou, X.L., Zhou, H., Li, J., Zhang, J.
Revision History (Full details and data files)
- Version 1.0: 2022-06-22
Type: Initial release - Version 1.1: 2023-11-29
Changes: Data collection, Refinement description
