Download MendeleyHalothane binds to druggable sites in the [Ca2+]4-calmodulin (CaM) complex, but does not inhibit [Ca2+]4-CaM activation of kinase.
Juranic, N.O., Jones, K.A., Penheiter, A.R., Hock, T.J., Streiff, J.H.(2013) J Serbian Chem Soc 78: 1655-1670
2KUH | pdb_00002kuh
Halothane binds to druggable sites in calcium-calmodulin: Solution structure of halothane-CaM C-terminal domain
- PDB DOI: https://doi.org/10.2210/pdb2KUH/pdb
- BMRB: 16764
- Classification: METAL BINDING PROTEIN
- Organism(s): Homo sapiens
- Expression System: Escherichia coli
- Mutation(s): No
- Deposited: 2010-02-17 Released: 2010-03-09
Experimental Data Snapshot
- Method: SOLUTION NMR
- Conformers Calculated: 50
- Conformers Submitted: 5
- Selection Criteria: structures with the lowest energy
wwPDB Validation 3D Report Full Report
This is version 1.3 of the entry. See complete history.
Literature
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| Calmodulin | 67 | Homo sapiens | Mutation(s): 0 Gene Names: |  | |
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for P0DP23 (Homo sapiens) Explore P0DP23 Go to UniProtKB: P0DP23 | |||||
PHAROS: P0DP23 GTEx: ENSG00000198668 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | P0DP23 | ||||
Sequence AnnotationsExpand | |||||
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Small Molecules
| Ligands 2 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| HLT Query on HLT | D [auth A] | 2-BROMO-2-CHLORO-1,1,1-TRIFLUOROETHANE C2 H Br Cl F3 BCQZXOMGPXTTIC-SFOWXEAESA-N |  | ||
| CA Query on CA | B [auth A], C [auth A] | CALCIUM ION Ca BHPQYMZQTOCNFJ-UHFFFAOYSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: SOLUTION NMR
- Conformers Calculated: 50
- Conformers Submitted: 5
- Selection Criteria: structures with the lowest energy
Entry History
Deposition Data
- Released Date: 2010-03-09 Deposition Author(s): Juranic, N., Macura, S., Simeonov, M.V., Jones, K.A., Penheiter, A.R., Hock, T.J., Streiff, J.H.
Revision History (Full details and data files)
- Version 1.0: 2010-03-09
Type: Initial release - Version 1.1: 2011-07-13
Changes: Version format compliance - Version 1.2: 2013-12-11
Changes: Database references - Version 1.3: 2024-05-01
Changes: Data collection, Database references, Derived calculations
