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Structure paper

TitleMolecular basis of human angiotensin-1 converting enzyme inhibition by a series of diprolyl-derived compounds.
Journal, issue, pagesFebs J., Vol. 292, Page 1141-1158, Year 2025
Publish dateJul 31, 2024 (structure data deposition date)
AuthorsGregory, K.S. / Cozier, G.E. / Fienberg, S. / Chibale, K. / Sturrock, E.D. / Acharya, K.R.
External linksFebs J. / PubMed:39763019
MethodsX-ray diffraction
Resolution1.9 - 2.4 Å
Structure data

PDB-9gbl:
Human Angiotensin-1 converting enzyme C-domain in complex with a diprolyl inhibitor- SG18
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-9gbm:
Human Angiotensin-1 converting enzyme C-domain in complex with a diprolyl inhibitor- SG3
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-9gbn:
Human Angiotensin-1 converting enzyme C-domain in complex with a diprolyl inhibitor- SG15
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-9gbo:
Human Angiotensin-1 converting enzyme C-domain in complex with a diprolyl inhibitor- SG16
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-9gbp:
Human Angiotensin-1 converting enzyme N-domain in complex with a diprolyl inhibitor- SG3
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-9gbq:
Human Angiotensin-1 converting enzyme N-domain in complex with a diprolyl inhibitor- SG15
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-9gbr:
Human Angiotensin-1 converting enzyme N-domain in complex with a diprolyl inhibitor- SG17
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-9gbs:
Human Angiotensin-1 converting enzyme N-domain in complex with a diprolyl inhibitor- SG18
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-CL:
Unknown entry

PDB-1ijy:
CRYSTAL STRUCTURE OF THE CYSTEINE-RICH DOMAIN OF MOUSE FRIZZLED 8 (MFZ8)

ChemComp-HOH:
WATER

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-BO3:
BORIC ACID

PDB-1ijw:
Testing the Water-Mediated Hin Recombinase DNA Recognition by Systematic Mutations.

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

PDB-1ijz:
Solution Structure of Human IL-13

ChemComp-BJ2:
(2~{S})-1-[(2~{S})-2-[[(1~{S})-1-[(2~{S})-1-[(2~{S})-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl]pyrrolidin-2-yl]-2-oxidanyl-2-oxidanylidene-ethyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

ChemComp-PG4:
TETRAETHYLENE GLYCOL / precipitant*YM

ChemComp-ACT:
ACETATE ION

ChemComp-MG:
Unknown entry

ChemComp-P33:
3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL / precipitant*YM

PDB-1ijx:
CRYSTAL STRUCTURE OF THE CYSTEINE-RICH DOMAIN OF SECRETED FRIZZLED-RELATED PROTEIN 3 (SFRP-3;FZB)

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-P6G:
HEXAETHYLENE GLYCOL / precipitant*YM

ChemComp-1PE:
PENTAETHYLENE GLYCOL / precipitant*YM

ChemComp-FUC:
alpha-L-fucopyranose

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Inhibitor / complex / protease

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