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Fluorine in PDB, part 190 (files: 7561-7600), PDB 7rt4-7w49

Experimental structures of coordination spheres of Fluorine (F) in bioorganic molecules from X-Ray and NMR experiments. Coordination spheres were calculated with 5.0 Angstroms radius around Fluorine atoms. PDB files: 7561-7600 (PDB 7rt4-7w49).
  1. 7rt4 (F: 1) - Kras G12D in Complex with Compound 5B (7-(8-Chloronaphthalen-1-Yl)-8- Fluoro-2-{[(2S)-1-Methylpyrrolidin-2-Yl]Methoxy}-4-(Piperazin-1-Yl) Pyrido[4,3-D]Pyrimidine)
    Other atoms: Mg (1); Cl (1);
  2. 7rt5 (F: 2) - Crystal Structure of Kras G12D with Compound 36 (4-[(1R,5S)-3,8- Diazabicyclo[3.2.1]Octan-3-Yl]-7-(8-Ethynyl-7-Fluoronaphthalen-1-Yl)- 8-Fluoro-2-{[(4S,7AS)-Tetrahydro-1H-Pyrrolizin-7A(5H)- Yl]Methoxy}Pyrido[4,3-D]Pyrimidine) Bound
    Other atoms: Mg (1);
  3. 7rtq (F: 24) - Sterol 14ALPHA Demethylase (CYP51) From Naegleria Fowleri in Complex with An Inhibitor R)-N-(1-(3,4'-Difluorobiphenyl-4-Yl)-2-(1H- Imidazol-1-Yl)Ethyl)-4-(5-Phenyl-1,3,4-Oxadiazol-2-Yl)Benzamide
    Other atoms: Fe (4);
  4. 7rud (F: 9) - Dahp Synthase Complex with Trifluoropyruvate Oxime
  5. 7rue (F: 12) - Dahp Synthase Complexed with Trifluoropyruvate Semicarbazone
    Other atoms: Mn (4);
  6. 7rxv (F: 3) - Human Methionine Adenosyltransferase 2A Bound to Methylthioadenosine, Malonate (Mla) and MGF3
    Other atoms: K (1); Na (2); Mg (2);
  7. 7ry8 (F: 3) - S. Cerevisiae CYP51 Y140H Mutant Complexed with Voriconazole
    Other atoms: Fe (1);
  8. 7ry9 (F: 3) - S. Cerevisiae CYP51 I471T Mutant Complexed with Voriconazole
    Other atoms: Fe (1);
  9. 7ryb (F: 3) - S. Cerevisiae CYP51 Y140H/I471T - Double Mutant Complexed with Voriconazole
    Other atoms: Fe (1);
  10. 7ryx (F: 7) - S. Cerevisiae CYP51 Complexed with Vt-1129
    Other atoms: Fe (1);
  11. 7rz4 (F: 12) - Structure of the Complex of Ampa Receptor GLUA2 with Auxiliary Subunit Tarp Gamma-5 Bound to Competitive Antagonist Zk 200775
  12. 7rz5 (F: 12) - Structure of the Complex of Lbd-Tmd Part of Ampa Receptor GLUA2 with Auxiliary Subunit Tarp Gamma-5 Bound to Competitive Antagonist Zk 200775
  13. 7s0v (F: 3) - The Role of An Asp-Asp Pair in the Structure, Function and Inhibition of Ctx-M Class A Beta-Lactamase
  14. 7s1n (F: 1) - N-Aromatic-Substituted Indazole Derivatives As Brain Penetrant and Orally Bioavailable JNK3 Inhibitors
    Other atoms: Cl (1);
  15. 7s4b (F: 1) - Room Temperature X-Ray Structure of Sars-Cov-2 Main Protease in Complex with Compound Z1530724963
  16. 7s4c (F: 3) - Crystal Structure of Inhibitor-Bound Galactokinase
    Other atoms: Cl (3); Na (2);
  17. 7s5g (F: 1) - PCSK9 in Complex with Compound 19
  18. 7s5h (F: 1) - PCSK9(Deltacrd) in Complex with Cyclic Peptide 35
  19. 7si9 (F: 3) - Room Temperature X-Ray Structure of Sars-Cov-2 Main Protease (Mpro) in Complex with Pf-07321332
  20. 7sq2 (F: 4) - Reprocessed and Refined Structure of Phospholipase C-Beta and Gq Signaling Complex
    Other atoms: Al (1); Ca (1); Mg (2);
  21. 7sqm (F: 2) - Discovery and Preclinical Pharmacology of INE963, A Potent and Fast- Acting Blood-Stage Antimalarial with A High Barrier to Resistance and Potential For Single-Dose Cure in Uncomplicated Malaria
  22. 7sse (F: 1) - Crystal Structure of the Wdr Domain of Human DCAF1 in Complex with Cyca-117-70
  23. 7vh6 (F: 18) - Cryo-Em Structure of the Hexameric Plasma Membrane H+-Atpase in the Active State (pH 6.0, BEF3-, Conformation 1, C1 Symmetry)
  24. 7vh8 (F: 3) - Crystal Structure of Sars-Cov-2 Main Protease in Complex with Protease Inhibitor Pf-07321332
  25. 7vkn (F: 1) - Crystal Structure of Trka (G595R) Kinase with Repotrectinib
  26. 7vko (F: 1) - Crystal Structure of Trka Kinase with Repotrectinib
  27. 7vpj (F: 4) - Cryo-Em Structure of the Human ATP13A2 (E1P-Adp State)
    Other atoms: Mg (1); Al (1);
  28. 7vpk (F: 3) - Cryo-Em Structure of the Human ATP13A2 (Spm-Bound E2P State)
    Other atoms: Mg (1);
  29. 7vpl (F: 4) - Cryo-Em Structure of the Human ATP13A2 (Spm-Bound E2PI State)
    Other atoms: Mg (1); Al (1);
  30. 7vsg (F: 3) - Cryo-Em Structure of A Human ATP11C-CDC50A Flippase Reconstituted in the Nanodisc in Ptdser-Occluded E2-Pi State.
  31. 7vsh (F: 4) - Cryo-Em Structure of A Human ATP11C-CDC50A Flippase Reconstituted in the Nanodisc in E1P State.
    Other atoms: Mg (1); Al (1);
  32. 7w47 (F: 5) - Crystal Structure of the Gastric Proton Pump Complexed with Tegoprazan
    Other atoms: Mg (1); Rb (3);
  33. 7w48 (F: 3) - Crystal Structure of the Gastric Proton Pump Complexed with Pf- 03716556
    Other atoms: Rb (3); Mg (1);
  34. 7w49 (F: 3) - Crystal Structure of the Gastric Proton Pump Complexed with Soraprazan
    Other atoms: Mg (1); Rb (2);
Page generated: Fri May 13 23:33:11 2022

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