Fluorine in PDB, part 151 (files: 6001-6040),
PDB 6pmb-6qei
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: 6001-6040 (PDB 6pmb-6qei).
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6pmb (F: 3) - Trk-A in Complex with Ligand 1A
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6pmd (F: 22) - Structure of Clpp From Staphylococcus Aureus in Complex with Acyldepsipeptide
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6pp9 (F: 1) - Crystal Structure of Braf:MEK1 Complex
Other atoms:
Mg (2);
I (1);
Cl (2);
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6prf (F: 4) - Hiv-1 Protease Multiple Drug Resistant Clinical Isolate Mutant PR20 with Grl-14213A
Other atoms:
Y (9);
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6pt2 (F: 12) - Crystal Structure of the Active Delta Opioid Receptor in Complex with the Peptide Agonist KGCHM07
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6pu7 (F: 2) - Human IDO1 in Complex with Compound 17 (N-{2-[(4-{N-[(7S)-4- Fluorobicyclo[4.2.0]Octa-1,3,5-Trien-7-Yl]-N'-Hydroxycarbamimidoyl}- 1,2,5-Oxadiazol-3-Yl)Sulfanyl]Ethyl}Acetamide)
Other atoms:
Fe (2);
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6puw (F: 3) - Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Bictegravir (Bic)
Other atoms:
Mg (2);
Zn (2);
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6puy (F: 2) - Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Insti XZ426 (Compound 4D)
Other atoms:
Mg (2);
Zn (2);
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6puz (F: 2) - Structure of Hiv Cleaved Synaptic Complex (Csc) Intasome Bound with Magnesium and Insti XZ446 (Compound 4F)
Other atoms:
Mg (2);
Zn (2);
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6pyy (F: 8) - Crystal Structure of Human Tryptophan 2,3-Dioxygenase in Complex with Pf-06840003 in Active Site and Exo Site
Other atoms:
Fe (4);
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6pyz (F: 4) - Crystal Structure of Human Tryptophan 2,3-Dioxygenase in Complex with Pf-06840003 in Active Site
Other atoms:
Fe (4);
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6pz1 (F: 3) - Crystal Structure of Human Indoleamine 2,3-Dioxygenase 1 in Complex with Pf-06840003 in Active Site and Si Site
Other atoms:
Fe (2);
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6pz4 (F: 2) - Co-Crystal Structure of Bace with Inhibitor Am-6494
Other atoms:
I (3);
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6pzo (F: 6) - Crystal Structure of Danio Rerio Histone Deacetylase 6 Catalytic Domain 2 Complexed with Yx-153
Other atoms:
K (4);
Zn (2);
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6q0j (F: 2) - Structure of A Mapk Pathway Complex
Other atoms:
Mg (2);
I (2);
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6q0t (F: 1) - Structure of A Mapk Pathway Complex
Other atoms:
Mg (1);
I (1);
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6q2t (F: 9) - Human Sterol 14A-Demethylase (CYP51) in Complex with the Functionally Irreversible Inhibitor (R)-N-(1-(3-Chloro-4'-Fluoro-[1,1'-Biphenyl]- 4-Yl)-2-(1H-Imidazol-1-Yl)Ethyl)-4-(5-(3-Fluoro-5-(5-Fluoropyrimidin- 4-Yl)Phenyl)-1,3,4-Oxadiazol-2-Yl)Benzamide
Other atoms:
Fe (2);
Cl (3);
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6q2w (F: 6) - Crystal Structure of Human Ror Gamma Lbd in Complex with A Quinoline Sulfonamide Inverse Agonist
Other atoms:
Cl (4);
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6q6f (F: 2) - Crystal Structure of IDH1 R132H in Complex with HMS101
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6q7b (F: 3) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with the Nvp-BHG712 Derivative ATDL09
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6q7c (F: 3) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with the Nvp-BHG712 Derivative ATDL11
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6q7d (F: 3) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with the Nvp-BHG712 Derivative ATDL13
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6q7e (F: 6) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with the Nvp-BHG712 Derivative ATDL14
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6q7f (F: 6) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with the Nvp-BHG712 Derivative ATDL18
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6q7g (F: 3) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with the Nvp-BHG712 Derivative ATHA01
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6q7h (F: 6) - RORCVAR2 (Rorgt, 264-499) in Complex with Compound 9 at 2.3A: Identification of N-Aryl Imidazoles As Potent and Selective Rorgt Inhibitors
Other atoms:
Cl (6);
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6q7v (F: 8) - Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 11
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6q7w (F: 4) - Crystal Structure of Pqsr (Mvfr) Ligand-Binding Domain in Complex with Compound 20
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6q9h (F: 1) - HDM2 (17-111, Wild Type) Complexed with Compound 11 at 2.0A; Structural States of HDM2 and Hdmx: X-Ray Elucidation of Adaptations and Binding Interactions For Different Chemical Compound Classes
Other atoms:
Cl (2);
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6q9o (F: 2) - HDM2 (17-111, Wildtype) Complexed with Compound 10 at 1.21A; Structural States of HDM2 and Hdmx: X-Ray Elucidation of Adaptations and Binding Interactions For Different Chemical Compound Classes
Other atoms:
Cl (4);
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6qas (F: 9) - Crystal Structure of ULK1 in Complexed with Pf-03814735
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6qba (F: 3) - Crystal Structure of Retinol-Binding Protein 4 (RBP4) in Complex with Non-Retinoid Ligand A1120 and Engineered Binding Scaffold
Other atoms:
Zn (3);
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6qbs (F: 6) - The Alkyne Moiety As A Latent Electrophile in Irreversible Covalent Small Molecule Inhibitors of Cathepsin K
Other atoms:
Ca (1);
Cl (2);
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6qdy (F: 1) - The Crystal Structure of Sporosarcina Pasteurii Urease in Complex with Its Substrate Urea
Other atoms:
Ni (2);
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6qdz (F: 2) - P38 Alpha Complex with AR117045
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6qe1 (F: 2) - P38 Alpha Complex with AR117046
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6qed (F: 1) - Crystal Structure of Human Methionine Aminopeptidase-2 in Complex; with An Inhibitor (S)-3-Hydroxy-2-Oxo-1-(2-Oxo-1,2,3,4-Tetrahydro- Quinolin-6-Yl)-Pyrrolidine-3-Carboxylic Acid 3-Chloro-5-Fluoro- Benzylamide
Other atoms:
Mn (2);
Cl (1);
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6qee (F: 4) - Nanodisc Reconstituted Human-Mouse Chimeric ABCB1 (ABCB1HM)-Eq Mutant in Complex with UIC2 Fab and Zosuquidar.
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6qef (F: 1) - Crystal Structure of Human Methionine Aminopeptidase-2 in Complex with An Inhibitor (S)-3-Hydroxy-2-Oxo-1-Phenyl-Pyrrolidine-3-Carboxylic Acid 3-Chloro-5-Fluoro-Benzylamide
Other atoms:
Mn (2);
Cl (1);
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6qei (F: 2) - Crystal Structure of Human Methionine Aminopeptidase-2 in Complex with An Inhibitor 5,6-Difluoro-3-(2-Isopropoxy-4-Piperazin-1-Yl-Phenyl)- 1H-Indole-2-Carboxylic Acid Amide
Other atoms:
Mn (2);
Page generated: Wed Nov 4 04:25:47 2020
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