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Fluorine in PDB, part 129 (files: 5121-5160), PDB 6bg5-6bxh

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: 5121-5160 (PDB 6bg5-6bxh).
  1. 6bg5 (F: 3) - Structure of 1-(Benzo[D][1,3]Dioxol-5-Ylmethyl)-1-(1-Propylpiperidin- 4-Yl)-3-(3-(Trifluoromethyl)Phenyl)Urea Bound to DCN1
  2. 6bgn (F: 15) - Crystal Structure of 4-Oxalocrotonate Tautomerase After Incubation with 5-Fluoro-2-Hydroxy-2,4-Pentadienoate
  3. 6bgw (F: 2) - Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (4,4-Difluoropiperidin-1-Yl)Ethoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine- 7-Carboxylic Acid(Compound N41)
    Other atoms: Mn (1); Cl (1);
  4. 6bgx (F: 2) - Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42)
    Other atoms: Mn (1); Cl (1);
  5. 6bkw (F: 2) - Btk Complex with Compound 12
  6. 6bkz (F: 2) - Novel Modes of Inhibition of Wild-Type IDH1: Non-Equivalent Allosteric Inhibition with CMPD3
  7. 6blf (F: 8) - PDE2 Complexed with 2-[6-Fluoro-8-Methylsulfonyl-9-[(1R)-1-[4- (Trifluoromethyl)Phenyl]Ethyl]-1,2,3,4-Tetrahydrocarbazol-1-Yl]Acetic Acid
    Other atoms: Mg (2); Zn (2);
  8. 6bln (F: 2) - Btk Complex with Compound 13
  9. 6bmf (F: 9) - VPS4P-VTA1P Complex with Peptide Binding to the Central Pore of VPS4P
    Other atoms: Mg (4);
  10. 6bn6 (F: 14) - Identification of Bicyclic Hexafluoroisopropyl Alcohol Sulfonamides As Rorgt/Rorc Inverse Agonists
  11. 6bns (F: 13) - Structure of Human Pregnane X Receptor Ligand Binding Domain Bound Tethered with Src Co-Activator Peptide and Compound 25A Aka Bicyclic Hexafluoroisopropyl 2 Alcohol Sulfonamides
  12. 6bp0 (F: 4) - Crystal Structure of the Human Vaccinia-Related Kinase 1 Bound to (R)- 2-Phenylaminopteridinone Inhibitor
    Other atoms: Cl (7);
  13. 6bpr (F: 2) - Crystal Structure of Cysteine, Nitric Oxide-Bound Ferrous Form of the Uncrosslinked F2-TYR157 Human Cysteine Dioxygenase
    Other atoms: Fe (1);
  14. 6bps (F: 2) - Crystal Structure of Cysteine-Bound Ferrous Form of the Uncrosslinked F2-TYR157 Human Cysteine Dioxygenase
    Other atoms: Fe (1);
  15. 6bpt (F: 2) - Crystal Structure of Ferrous Form of the Uncrosslinked F2-TYR157 Human Cysteine Dioxygenase
    Other atoms: Fe (1);
  16. 6bpu (F: 3) - Crystal Structure of Ferrous Form of the F2-TYR157 Human Cysteine Dioxygenase with Both Uncrosslinked and Crosslinked Cofactor
    Other atoms: Fe (1);
  17. 6bpv (F: 1) - Crystal Structure of Cysteine-Bound Ferrous Form of the Matured F2- TYR157 Human Cysteine Dioxygenase
    Other atoms: Fe (1);
  18. 6bq0 (F: 3) - Structure of Human Monoacylglycerol Lipase Bound to A Covalent Inhibitor
  19. 6bq1 (F: 2) - Human PI4KIIIA Lipid Kinase Complex
  20. 6bqh (F: 2) - Crystal Structure of 5-HT2C in Complex with Ritanserin
  21. 6bqj (F: 6) - Crystal Structure of Hepatis C Virus Protease (NS3) Complexed with Tripeptidic Acyl Sulfonamide Inhibitor (Compound 16)
    Other atoms: Cl (3); Zn (3);
  22. 6bqk (F: 4) - Crystal Structure of Hepatis C Virus Protease (NS3) Complexed with Tripeptidic Acyl Sulfonamide Inhibitor (Compound 18)
    Other atoms: Cl (2); Zn (2);
  23. 6bqo (F: 2) - Structure of A Dual Topology Fluoride Channel with Monobody S8
    Other atoms: Na (1);
  24. 6br2 (F: 2) - Structure of Rorgt in Complex with A Novel Isoquinoline Inverse Agonist.
  25. 6br3 (F: 2) - Structure of Rorgt in Complex with A Novel Inverse Agonist Tak-828.
  26. 6br7 (F: 6) - Beryllium Fluorinated Receiver Domain of Bfmr From Acinetobacter Baumannii
    Other atoms: Mg (2);
  27. 6bru (F: 4) - Crystal Structure of the Human Vaccinia-Related Kinase Bound to A (S)- 2-Phenylaminopteridinone Inhibitor
  28. 6bsg (F: 3) - Structure of Hiv-1 Rt Complexed with Rna/Dna Hybrid in An Rna Hydrolysis-Off Mode
    Other atoms: Ca (2); Cl (1);
  29. 6bsh (F: 3) - Structure of Hiv-1 Rt Complexed with Rna/Dna Hybrid in the Rna Hydrolysis Mode
    Other atoms: Ca (2); Cl (1);
  30. 6bsi (F: 3) - Structure of Hiv-1 Rt Complexed with An Rna/Dna Hybrid Containing the Polypurine-Tract Sequence
    Other atoms: Ca (2); Cl (1);
  31. 6bsj (F: 3) - Structure of Hiv-1 Rt Complexed with An Rna/Dna Hybrid Sequence Non- Preferred For Rna Hydrolysis
    Other atoms: Ca (1); Cl (1);
  32. 6bt6 (F: 12) - Ctx-M-14 S237A Beta-Lactamase in Complex with A Non-Covalent Tetrazole Inhibitor
  33. 6btw (F: 6) - Crystal Structure of the Human Vaccinia-Related Kinase Bound to A Phenyl-Pteridinone Inhibitor
    Other atoms: Cl (9);
  34. 6bu3 (F: 12) - Ctx-M-27 Beta-Lactamase in Complex with A Non-Covalent Tetrazole Inhibitor
  35. 6bu6 (F: 12) - Crystal Structure of the Human Vaccinia-Related Kinase Bound to A Bis- Difluorophenol-Aminopyridine Inhibitor
    Other atoms: Cl (6);
  36. 6bvf (F: 2) - Cryo-Em Structure of Hepatitis B Virus T=4 Capsid in Complex with the Fluorescent Allosteric Modulator Hap-Tamra
    Other atoms: Cl (2);
  37. 6bvn (F: 1) - Cryo-Em Structure of Hepatitis B Virus T=3 Capsid in Complex with the Fluorescent Allosteric Modulator Hap-Tamra
    Other atoms: Cl (1);
  38. 6bx4 (F: 4) - The Crystal Structure of Fluoride Channel Fluc EC2 with Monobody S9
    Other atoms: Na (1);
  39. 6bx5 (F: 4) - The Crystal Structure of Fluoride Channel Fluc EC2 with Monobody S12
    Other atoms: Na (1);
  40. 6bxh (F: 4) - Menin in Complex with Mi-853
Page generated: Wed Nov 4 04:24:17 2020

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