1HT5
THE 2.75 ANGSTROM RESOLUTION MODEL OF OVINE COX-1 COMPLEXED WITH METHYL ESTER FLURBIPROFEN
- PDB DOI: https://doi.org/10.2210/pdb1HT5/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Ovis aries
- Mutation(s): No 
- Deposited: 2000-12-28 Released: 2001-04-11 
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.75 Å
- R-Value Free: 0.252 
- R-Value Work: 0.223 
- R-Value Observed: 0.223 
This is version 1.4 of the entry. See complete history. 
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
---|---|---|---|---|---|
Molecule | Chains | Sequence Length | Organism | Details | Image |
PROSTAGLANDIN H2 SYNTHASE-1 | 551 | Ovis aries | Mutation(s): 0  EC: 1.14.99.1 | ||
UniProt | |||||
Find proteins for P05979 (Ovis aries) Explore P05979  Go to UniProtKB:  P05979 | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | P05979 | ||||
Sequence AnnotationsExpand | |||||
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Small Molecules
Ligands 4 Unique | |||||
---|---|---|---|---|---|
ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
HEM Query on HEM | I [auth A], R [auth B] | PROTOPORPHYRIN IX CONTAINING FE C34 H32 Fe N4 O4 KABFMIBPWCXCRK-RGGAHWMASA-L | |||
BOG Query on BOG | C [auth A], L [auth B], M [auth B] | octyl beta-D-glucopyranoside C14 H28 O6 HEGSGKPQLMEBJL-RKQHYHRCSA-N | |||
FL2 Query on FL2 | J [auth A], S [auth B] | FLURBIPROFEN METHYL ESTER C16 H15 F O2 CPJBKHZROFMSQM-NSHDSACASA-N | |||
NAG Query on NAG | D [auth A] E [auth A] F [auth A] G [auth A] H [auth A] | 2-acetamido-2-deoxy-beta-D-glucopyranose C8 H15 N O6 OVRNDRQMDRJTHS-FMDGEEDCSA-N |
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.75 Å
- R-Value Free: 0.252 
- R-Value Work: 0.223 
- R-Value Observed: 0.223 
- Space Group: I 2 2 2
Unit Cell:
Length ( Å ) | Angle ( ˚ ) |
---|---|
a = 98.888 | α = 90 |
b = 209.45 | β = 90 |
c = 223.013 | γ = 90 |
Software Name | Purpose |
---|---|
DENZO | data reduction |
SCALEPACK | data scaling |
CNS | refinement |
CNS | phasing |
Entry History 
Deposition Data
- Released Date: 2001-04-11  Deposition Author(s): Selinsky, B.S., Gupta, K., Sharkey, C.T., Loll, P.J.
Revision History (Full details and data files)
- Version 1.0: 2001-04-11
Type: Initial release - Version 1.1: 2008-04-27
Changes: Version format compliance - Version 1.2: 2011-07-13
Changes: Non-polymer description, Version format compliance - Version 1.3: 2020-07-29
Type: Remediation
Reason: Carbohydrate remediation
Changes: Advisory, Data collection, Derived calculations, Structure summary - Version 1.4: 2023-08-09
Changes: Data collection, Database references, Refinement description, Structure summary