1PGG
PROSTAGLANDIN H2 SYNTHASE-1 COMPLEXED WITH 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYLINDOLE-3-ACETIC ACID (IODOINDOMETHACIN), TRANS MODEL
- PDB DOI: https://doi.org/10.2210/pdb1PGG/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Ovis aries
- Mutation(s): No 
- Deposited: 1995-12-02 Released: 1997-01-11 
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 4.50 Å
- R-Value Free: 0.267 
- R-Value Work: 0.254 
- R-Value Observed: 0.254 
wwPDB Validation   3D Report Full Report
This is version 2.0 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 | 576 | 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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Oligosaccharides
Small Molecules
Ligands 3 Unique | |||||
---|---|---|---|---|---|
ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
HEM Query on HEM | G [auth A], K [auth B] | PROTOPORPHYRIN IX CONTAINING FE C34 H32 Fe N4 O4 KABFMIBPWCXCRK-RGGAHWMASA-L | |||
IMM Query on IMM | H [auth A], L [auth B] | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-3-ACETIC ACID C19 H16 I N O4 CXBFZYKAVCAPSV-UHFFFAOYSA-N | |||
NAG Query on NAG | E [auth A], F [auth A], I [auth B], J [auth B] | 2-acetamido-2-deoxy-beta-D-glucopyranose C8 H15 N O6 OVRNDRQMDRJTHS-FMDGEEDCSA-N |
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 4.50 Å
- R-Value Free: 0.267 
- R-Value Work: 0.254 
- R-Value Observed: 0.254 
- Space Group: I 2 2 2
Unit Cell:
Length ( Å ) | Angle ( ˚ ) |
---|---|
a = 99.22 | α = 90 |
b = 208.99 | β = 90 |
c = 232.43 | γ = 90 |
Software Name | Purpose |
---|---|
MADNES | data collection |
X-PLOR | model building |
X-PLOR | refinement |
MADNES | data reduction |
X-PLOR | phasing |
Entry History 
Deposition Data
- Released Date: 1997-01-11  Deposition Author(s): Loll, P.J., Picot, D., Garavito, R.M.
Revision History (Full details and data files)
- Version 1.0: 1997-01-11
Type: Initial release - Version 1.1: 2008-03-24
Changes: Version format compliance - Version 1.2: 2011-07-13
Changes: Non-polymer description, Version format compliance - Version 1.3: 2018-04-18
Changes: Data collection, Other - Version 2.0: 2020-07-29
Type: Remediation
Reason: Carbohydrate remediation
Changes: Atomic model, Data collection, Derived calculations, Structure summary