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Fluorine in PDB, part 207 (files: 8241-8280), PDB 7si3-7t09

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: 8241-8280 (PDB 7si3-7t09).
  1. 7si3 (F: 4) - Consensus Structure of ATP7B
    Other atoms: Mg (1); Al (1);
  2. 7si4 (F: 1) - Crystal Structure of Eed with Mrtx-2219
  3. 7si5 (F: 1) - Crystal Structure of Eed with Mrtx-1919
    Other atoms: Na (2);
  4. 7si6 (F: 4) - Structure of ATP7B in State 1
    Other atoms: Mg (1); Al (1);
  5. 7si7 (F: 4) - Structure of ATP7B in State 2
    Other atoms: Mg (1); Al (1);
  6. 7si9 (F: 3) - Room Temperature X-Ray Structure of Sars-Cov-2 Main Protease (Mpro) in Complex with Pf-07321332
  7. 7sii (F: 8) - Human Sting Bound to Both Cgamp and 1-[(2-Chloro-6-Fluorophenyl) Methyl]-3,3-Dimethyl-2-Oxo-N-[(2,4,6-Trifluorophenyl)Methyl]-2,3- Dihydro-1H-Indole-6-Carboxamide (Compound 53)
    Other atoms: Cl (2);
  8. 7sj3 (F: 2) - Structure of CDK4-Cyclin D3 Bound to Abemaciclib
  9. 7slr (F: 7) - Hiv Reverse Transcriptase with Compound PYR01
  10. 7sls (F: 7) - Hiv Reverse Transcriptase with Compound PYR02
  11. 7snl (F: 5) - Disulfide Stabilized Hiv-1 Ca Hexamer in Complex with Capsid Inhibitor N-(1-(3-(4-Chloro-1-Methyl-3-(Methylsulfonamido)-1H-Indazol-7-Yl)-4- Oxo-3,4-Dihydropyrido[2,3-D]Pyrimidin-2-Yl)-2-(3,5-Difluorophenyl) Ethyl)-2-(3-(Trifluoromethyl)-4,5,6,7-Tetrahydro-1H-Indazol-1-Yl) Acetamide
    Other atoms: I (4); Cl (8);
  12. 7snn (F: 4) - Disulfide Stabilized Hiv-1 Ca Hexamer in Complex with Capsid Inhibitor N-(1-(3-(4-Chloro-1-Methyl-3-(Methylsulfonamido)-1H-Indazol-7-Yl)-4- Oxo-3,4-Dihydropyrido[2,3-D]Pyrimidin-2-Yl)-2-(3,5-Difluorophenyl) Ethyl)-2-(3-(Difluoromethyl)-5,6-Dihydrocyclopenta[C]Pyrazol-1(4H)- Yl)Acetamide
    Other atoms: I (3); Cl (8);
  13. 7so4 (F: 1) - Crystal Structure of Hiv-1 Y181C Mutant Reverse Transcriptase in Complex with 5-(2-(2-(2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-Yl) Ethoxy)Phenoxy)-7-Fluoro-2-Naphthonitrile (JLJ635), A Non-Nucleoside Inhibitor
  14. 7so6 (F: 1) - Crystal Structure of Hiv-1 K103N, Y181C Mutant Reverse Transcriptase in Complex with 5-(2-(2-(2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-Yl) Ethoxy)Phenoxy)-7-Fluoro-2-Naphthonitrile (JLJ635), A Non-Nucleoside Inhibitor
    Other atoms: Mg (1);
  15. 7sp3 (F: 1) - E. Coli Rpph Bound to AP4A
    Other atoms: Mg (3); Cl (1);
  16. 7sps (F: 4) - Crystal Structure of Human Glucose Transporter GLUT3 Bound with Exofacial Inhibitor SA47
  17. 7sq2 (F: 4) - Reprocessed and Refined Structure of Phospholipase C-Beta and Gq Signaling Complex
    Other atoms: Al (1); Ca (1); Mg (2);
  18. 7sql (F: 5) - Crystal Structure of Human Uridine-Cytidine Kinase 2 Complexed with A Weak Small Molecule Inhibitor
    Other atoms: Br (5);
  19. 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
  20. 7ss1 (F: 2) - The Structure of NTMT1 in Complex with Compound GD433
  21. 7ss6 (F: 3) - Structure of Klebsiella Lpxh in Complex with Jh-Lph-45
    Other atoms: Cl (1); Mn (2);
  22. 7ss7 (F: 3) - Crystal Structure of Klebsiella Lpxh in Complex with Jh-Lph-50
    Other atoms: Cl (1); Mn (2);
  23. 7sse (F: 1) - Crystal Structure of the Wdr Domain of Human DCAF1 in Complex with Cyca-117-70
  24. 7ssj (F: 9) - Crystal Structure of the Desk-Desr Complex in the Phosphatase State
    Other atoms: Mg (6);
  25. 7sui (F: 3) - Structure of CHK1 10-Pt. Mutant Complex with LRRK2 Inhibitor 22
    Other atoms: Cl (2);
  26. 7suj (F: 4) - Structure of CHK1 10-Pt. Mutant Complex with LRRK2 Inhibitor 24
    Other atoms: Cl (2);
  27. 7sup (F: 10) - uc(Nmr) Structure of Ctnc-Tni Chimera Bound to Calcium and A1
    Other atoms: Ca (10);
  28. 7sv1 (F: 1) - Carbonic Anhydrase IX-Mimic Complexed with 3-((2-((Naphthalen-2- Ylmethyl)(4-Sulfamoylphenethyl)Amino)-2-Oxoethyl)(Phenethyl)Amino) Propanoic Acid
    Other atoms: Zn (1);
  29. 7sv7 (F: 3) - The Complex of Phosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) with Atp/Mg and Tezacaftor (Vx-661)
    Other atoms: Mg (2);
  30. 7svc (F: 10) - uc(Nmr) Structure of Ctnc-Tni Chimera Bound to Calcium and A2
    Other atoms: Ca (10);
  31. 7svd (F: 2) - The Complex of Phosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) with Atp/Mg and Lumacaftor (Vx-809)
    Other atoms: Mg (2);
  32. 7svn (F: 4) - DPP9 in Complex with Ligand Iced-1
  33. 7svo (F: 3) - DPP8 in Complex with Ligand Iced-1
  34. 7svr (F: 2) - The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809)
  35. 7swg (F: 10) - Ctnc-Tni Chimera Complexed with A1
  36. 7swi (F: 10) - Ctnc-Tni Chimera Complexed with A2
  37. 7sxg (F: 2) - Bio-8546 Bound GSK3ALPHA-Axin Complex
  38. 7sxh (F: 2) - Bio-8546 Bound GSK3BETA-Axin Complex
  39. 7t08 (F: 4) - Cryptococcus Neoformans Protein Farnesyltransferase in Complex with Fpp and Inhibitor 2Q
    Other atoms: Zn (1);
  40. 7t09 (F: 3) - Cryptococcus Neoformans Protein Farnesyltransferase in Complex with Fpp and Inhibitor 2D
    Other atoms: Zn (1);
Page generated: Thu Dec 28 04:17:45 2023

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