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Fluorine in PDB, part 206 (files: 8201-8240), PDB 7re1-7rrz

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: 8201-8240 (PDB 7re1-7rrz).
  1. 7re1 (F: 6) - Sars-Cov-2 Replication-Transcription Complex Bound to NSP13 Helicase - NSP13(2)-Rtc (Composite)
    Other atoms: Mg (3); Al (2); Zn (8);
  2. 7re2 (F: 3) - Sars-Cov-2 Replication-Transcription Complex Bound to NSP13 Helicase - NSP13(1)-Rtc
    Other atoms: Zn (5); Al (1); Mg (2);
  3. 7re3 (F: 12) - Sars-Cov-2 Replication-Transcription Complex Bound to NSP13 Helicase - NSP13(2)-Rtc Dimer
    Other atoms: Zn (16); Al (4); Mg (6);
  4. 7ree (F: 2) - High-Resolution Crystal Structure of Human JAK2 Kinase Domain (JH1) Bound to YM2-059
  5. 7rek (F: 2) - Crystal Structure of the First Bromodomain (BD1) of Human BRD4 in Complex with Dual BRD4-JAK2 Inhibitor MA9-086
  6. 7rel (F: 1) - Crystal Structure of the First Bromodomain (BD1) of Human BRD4 in Complex with Dual BRD4-JAK2 Inhibitor MA9-060
    Other atoms: Cl (1);
  7. 7rem (F: 4) - Crystal Structure of the First Bromodomain (BD1) of Human BRD4 in Complex with Dual BRD4-JAK2 Inhibitor PN1-050
    Other atoms: Cl (1);
  8. 7rfd (F: 6) - E. Coli Peptidyl-Prolyl Cis-Trans Isomerase, Mutant PHE4ALA PHE27CF3- Phe/PHE98CF3-Phe
  9. 7rfs (F: 3) - Structure of Sars-Cov-2 Main Protease in Complex with A Covalent Inhibitor
  10. 7rfw (F: 3) - Structure of Sars-Cov-2 Main Protease in Complex with A Covalent Inhibitor
  11. 7rgz (F: 1) - Crystal Structure of Human Galectin-3 Crd in Complex with Methyl 2-O- (2-Nitro-4-Fluoro)-Benzoyl-3-O-Toluoyl-B-D-Talopyranoside
    Other atoms: Cl (2);
  12. 7rh0 (F: 3) - Crystal Structure of Human Galectin-3 Crd in Complex with Methyl 2-O- (2-Nitro-4-Trifluoromethyl-Benzoyl)-3-O-Toluoyl-B-D-Talopyranoside
    Other atoms: Cl (2);
  13. 7rh4 (F: 1) - Co-Crystallization of Human Galectin-3 Crd Complex with Methyl 2-O-(2- Nitro-4-Fluoro)-Benzoyl-3-O-Toluoyl-B-D-Talopyranoside
    Other atoms: Cl (1);
  14. 7rh7 (F: 6) - Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound
    Other atoms: Fe (16); Cl (2); Cu (6);
  15. 7rhn (F: 20) - Co-Crystal Structure of Q67H Mutant of Disulfide Stabilized Hiv-1 Ca Hexamer and Lenacapavir
    Other atoms: I (3); Cl (6);
  16. 7rio (F: 3) - Human Pxr Lbd Bound to GSK003
  17. 7riu (F: 1) - Human Pxr Lbd Bound to GSK002
  18. 7riv (F: 3) - Human Pxr Lbd Bound to GSK001
  19. 7rj2 (F: 20) - Co-Crystal Structure of Lenacapavir Bound to Q67H/N74D Mutant of Disulfide Stabilized Hiv-1 Ca Hexamer
    Other atoms: I (1); Cl (6);
  20. 7rj4 (F: 30) - Co-Crystal Structure of Lenacapavir Bound to N74D Mutant of Disulfide Stabilized Hiv-1 Ca Hexamer
    Other atoms: Cl (21); I (3);
  21. 7rj8 (F: 2) - Crystal Structure of AP2 Associated Kinase 1 Isoform 1 Complexed with Ligand (2R)-2-Amino-N-[3-(Difluorom Ethoxy)-4-(1,3-Oxazol-5-Yl) Phenyl]-4-Methylpentanamide
  22. 7rje (F: 8) - Complex III2 From Candida Albicans, Inz-5 Bound
    Other atoms: Fe (10);
  23. 7rkr (F: 4) - Naegleria Fowleri CYP51 (NFCYP51) Complex with (S)-1-(4-Fluorophenyl)- 2-(1H-Imidazol-1-Yl)Ethyl 3-(Trifluoromethyl)Benzoate
    Other atoms: Ca (2); Fe (1);
  24. 7rkt (F: 3) - Naegleria Fowleri CYP51 (NFCYP51) Complex with (S)-1-(2,4- Dichlorophenyl)-2-(1H-Imidazol-1-Yl)Ethyl 3-(Trifluoromethyl)Benzoate
    Other atoms: Fe (1); Cl (2);
  25. 7rkw (F: 1) - Naegleria Fowleri CYP51(NFCYP51) Complex with (S)-1-(4-Fluorophenyl)- 2-(1H-Imidazol-1-Yl)Ethyl 3,5-Dichlorobenzoate
    Other atoms: Cl (2); Fe (1);
  26. 7rme (F: 3) - Room Temperature X-Ray Structure of Sars-Cov-2 Main Protease (Mpro) in Complex with Hl-3-52
    Other atoms: Cl (1);
  27. 7rmj (F: 48) - Disulfide Stabilized Hiv-1 Ca Hexamer in Complex with Capsid Inhibitor (S)-N-(1-(3-(4-Chloro-3-(Methylsulfonamido)-1-(2,2,2-Trifluoroethyl)- 1H-Indazol-7-Yl)-6-(3-Methyl-3-(Methylsulfonyl)But-1-Yn-1-Yl)Pyridin- 2-Yl)-2-(3,5-Difluorophenyl)Ethyl)-2-(3-(Trifluoromethyl)-4,5,6,7- Tetrahydro-1H-Indazol-1-Yl)Acetamide
    Other atoms: I (5); Cl (23);
  28. 7rmz (F: 3) - Room Temperature X-Ray Structure of Sars-Cov-2 Main Protease (Mpro) in Complex with Hl-3-63
    Other atoms: Cl (1);
  29. 7rn6 (F: 3) - High-Resolution Crystal Structure of Human JAK2 Kinase Domain (JH1) Bound to Type-II Inhibitor BBT594
  30. 7roj (F: 12) - Amyloid-Related Segment of Alphab-Crystallin Residues 90-100 with G95W Mutation
    Other atoms: Na (1);
  31. 7ros (F: 4) - Plasmodium Falciparum Tyrosyl-Trna Synthetase in Complex with ML901- Tyr
    Other atoms: Mg (2); Cl (2);
  32. 7rot (F: 4) - Plasmodium Falciparum Tyrosyl-Trna Synthetase, S234C Mutant, in Complex with ML901-Tyr
    Other atoms: Cl (1); Mg (2);
  33. 7rou (F: 2) - Structure of Human Tyrosyl Trna Synthetase in Complex with ML901-Tyr
  34. 7rpz (F: 3) - Kras G12D in Complex with Mrtx-1133
    Other atoms: Mg (1);
  35. 7rrb (F: 2) - IDO1 in Complex with Compound 9
  36. 7rrc (F: 8) - IDO1 in Complex with Compound 14
  37. 7rrd (F: 2) - IDO1 in Complex with Compound S-1
  38. 7rrx (F: 12) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (L372S, L536S) in Complex with Dmeri-19
    Other atoms: Cl (2);
  39. 7rry (F: 12) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (L372S, L536S) in Complex with Dmeri-20
    Other atoms: Cl (2);
  40. 7rrz (F: 12) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (L372S, L536S) in Complex with Dmeri-30
Page generated: Wed Nov 13 08:13:06 2024

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