Title Crystallographic fragment screen of the c-di-AMP-synthesizing enzyme CdaA from Bacillus subtilis. Journal, issue, pages Acta Crystallogr. ,Sect. F , Vol. 80, Page 200-209, Year 2024Publish date Mar 15, 2023 (structure data deposition date) AuthorsGarbers, T. / Neumann, P. / Wollenhaupt, J. / Dickmanns, A. / Weiss, M.S. / Ficner, R. External links Acta Crystallogr. ,Sect. F / PubMed:39177700Methods X-ray diffraction Resolution 1.1 - 2.45 Å Structure data PDB-8ofh : Structure viewerStreptococcus pneumoniae CdaAMethod : X-RAY DIFFRACTION / Resolution : 1.64 Å
PDB-8ofo : Structure viewerStructure of Enterococcus faecium CdaAMethod : X-RAY DIFFRACTION / Resolution : 2.45 Å
PDB-8ogm : Structure viewer Crystal structure of CdaA from Bacillus subtilisMethod : X-RAY DIFFRACTION / Resolution : 1.1 Å
PDB-8ogn : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry A09 Method : X-RAY DIFFRACTION / Resolution : 1.29 Å
PDB-8ogo : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry A12 Method : X-RAY DIFFRACTION / Resolution : 1.21 Å
PDB-8ogp : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B03 Method : X-RAY DIFFRACTION / Resolution : 1.22 Å
PDB-8ogq : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B06 Method : X-RAY DIFFRACTION / Resolution : 1.42 Å
PDB-8ogr : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B07 Method : X-RAY DIFFRACTION / Resolution : 1.35 Å
PDB-8ogs : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry B08 Method : X-RAY DIFFRACTION / Resolution : 1.25 Å
PDB-8ogt : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C04 Method : X-RAY DIFFRACTION / Resolution : 1.5 Å
PDB-8ogu : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C07 Method : X-RAY DIFFRACTION / Resolution : 1.41 Å
PDB-8ogv : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry C08 Method : X-RAY DIFFRACTION / Resolution : 1.25 Å
PDB-8ogw : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D02 Method : X-RAY DIFFRACTION / Resolution : 1.17 Å
PDB-8ogy : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D04 Method : X-RAY DIFFRACTION / Resolution : 1.23 Å
PDB-8ogz : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D06 Method : X-RAY DIFFRACTION / Resolution : 1.14 Å
PDB-8oh0 : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry D08 Method : X-RAY DIFFRACTION / Resolution : 1.27 Å
PDB-8oh1 : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry E04 Method : X-RAY DIFFRACTION / Resolution : 1.22 Å
PDB-8ohb : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry E08 Method : X-RAY DIFFRACTION / Resolution : 1.11 Å
PDB-8ohc : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry E12 Method : X-RAY DIFFRACTION / Resolution : 1.17 Å
PDB-8ohe : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry F03 Method : X-RAY DIFFRACTION / Resolution : 1.15 Å
PDB-8ohf : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry F04 Method : X-RAY DIFFRACTION / Resolution : 1.22 Å
PDB-8ohg : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry F09 Method : X-RAY DIFFRACTION / Resolution : 1.25 Å
PDB-8ohh : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry G05 Method : X-RAY DIFFRACTION / Resolution : 1.3 Å
PDB-8ohj : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry G08 Method : X-RAY DIFFRACTION / Resolution : 1.22 Å
PDB-8ohk : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry H01 Method : X-RAY DIFFRACTION / Resolution : 1.26 Å
PDB-8ohl : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry H09 Method : X-RAY DIFFRACTION / Resolution : 1.29 Å
PDB-8oho : Structure viewer PanDDA analysis group deposition -- CdaA in complex with fragment F2X-Entry H11 Method : X-RAY DIFFRACTION / Resolution : 1.32 Å
PDB-9g0g : Structure viewer BsCdaA in complex with Compound 7Method : X-RAY DIFFRACTION / Resolution : 1.7 Å
Chemicals ChemComp-P4G : Structure viewer 1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE
ChemComp-TJ1 : Structure viewer 3-(propan-2-yl)-1,2,4-oxadiazol-5(4H)-one
ChemComp-SYG : Structure viewer 2-[(1~{S})-1-azanylpropyl]phenol
ChemComp-R8P : Structure viewer (1S)-1-(4-nitrophenyl)ethan-1-ol
ChemComp-T9S : Structure viewer ethyl 1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate
ChemComp-R8S : Structure viewer 2-hydrazinyl-4-methoxypyrimidine
ChemComp-R8V : Structure viewer (3S)-3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one
ChemComp-SY4 : Structure viewer ~{N}-[5-azanyl-2,4-bis(fluoranyl)phenyl]propane-1-sulfonamide
ChemComp-RQD : Structure viewer methyl 4-fluoro-L-phenylalaninate
ChemComp-SYV : Structure viewer 6-azanyl-3-methyl-1,3-benzoxazol-2-one
ChemComp-RAY : Structure viewer N-(3-fluorophenyl)-2-(2-methoxyethoxy)acetamide
ChemComp-RB7 : Structure viewer N-[(4-bromo-3-methylphenyl)methyl]-2-(methylsulfonyl)ethan-1-amine
ChemComp-RDJ : Structure viewer N-ethyl-2-{[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide
ChemComp-TBJ : Structure viewer N-cyclopentyl-N'-{[(2R)-oxolan-2-yl]methyl}urea
ChemComp-REG : Structure viewer 1-cyclopentyl-3-[[(2~{S})-oxolan-2-yl]methyl]urea
ChemComp-TJ9 : Structure viewer ~{N}-[5-(2-azanyl-1,3-thiazol-4-yl)-4-methyl-1,3-thiazol-2-yl]ethanamide
ChemComp-DMS : Structure viewer DIMETHYL SULFOXIDE / DMSO, precipitant*YM
Source streptococcus pneumoniae r6 (bacteria)enterococcus faecium (bacteria)bacillus subtilis subsp. subtilis str. 168 (bacteria)bacillus subtilis (bacteria) Keywords TRANSFERASE / diadenylate cyclase / CdaA / Cyclic-di-AMP