Fluorine in PDB, part 121 (files: 4801-4840),
PDB 5vbp-5vro
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: 4801-4840 (PDB 5vbp-5vro).
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5vbp (F: 4) - Crystal Structure of the First Bromodomain of Human BRD4 in Complex with RO3280
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5vbz (F: 3) - Crystal Structure of Small Molecule Disulfide 2C07 Bound to H-Ras M72C Gppnhp
Other atoms:
Mg (3);
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5vcw (F: 2) - Crystal Structure of Human MYT1 Kinase Domain in Complex with Pelitinib
Other atoms:
Cl (2);
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5vd2 (F: 3) - Crystal Structure of Human WEE1 Kinase Domain in Complex with Pf- 03814735
Other atoms:
Cl (2);
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5vd4 (F: 3) - Crystal Structure of Human WEE1 Kinase Domain in Complex with Rac-IV- 016, A MK1775 Analougue
Other atoms:
Cl (1);
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5vd7 (F: 1) - Crystal Structure of Human WEE1 Kinase Domain in Complex with Rac-IV- 098, A MK1775 Analogue
Other atoms:
Cl (1);
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5vee (F: 1) - PAK4 Kinase Domain in Complex with FRAX486
Other atoms:
Cl (2);
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5vej (F: 1) - High Resolution Crystal Structure of A Fluoride-Inhibited Organo- Phosphate-Degrading Metallohydrolase
Other atoms:
Co (2);
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5vew (F: 6) - Structure of the Human Glp-1 Receptor Complex with Pf-06372222
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5vhc (F: 3) - DHX36 with An N-Terminal Truncation Bound to Adp-BEF3
Other atoms:
Mg (1);
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5vhd (F: 4) - DHX36 with An N-Terminal Truncation Bound to Adp-ALF4
Other atoms:
Al (1);
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5vhw (F: 12) - GLUA2-0XGSG1L Bound to Zk
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5vhx (F: 12) - GLUA2-1XGSG1L Bound to Zk
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5vhy (F: 12) - GLUA2-2XGSG1L Bound to Zk
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5vi9 (F: 1) - Crystal Structure of Protein Kinase A in Complex with the Pki Peptide and Aminobenzothiazole Based Inhibitors
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5vih (F: 1) - Crystal Structure of GLUN1/GLUN2A Nmda Receptor Agonist Binding Domains with Glycine and Antagonist, 4-Fluorophenyl-Acepc
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5vii (F: 1) - Crystal Structure of GLUN1/GLUN2A Nmda Receptor Agonist Binding Domains with Glycine and Antagonist, 4-(3-Fluoropropyl)Phenyl-Acepc
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5vj3 (F: 3) - Hiv Protease (Pr) in Open Form with MG2+ in Active Site and Hive-9 in Eye Site
Other atoms:
Mg (1);
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5vlr (F: 3) - Crystal Structure of PI3K Delta in Complex with A Trifluoro-Ethyl- Pyrazol-Pyrolotriazine Inhibitor
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5vo1 (F: 3) - Dlk in Complex with Compound 10 (5-(1-Isopropyl-5-(3-(Oxetan-3-Yl)-3- Azabicyclo[3.1.0]Hexan-6-Yl)-1H-Pyrazol-3-Yl)-3-(Trifluoromethyl) Pyridin-2-Amine)
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5vo2 (F: 3) - Dlk in Complex with Inhibitor 5-(1-Isopropyl-5-(1-(Oxetan-3-Yl) Piperidin-4-Yl)-1H-Pyrazol-3-Yl)-3-(Trifluoromethyl)Pyridin-2-Amine (Compound 7)
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5vo4 (F: 1) - Crystal Structure of the Androgen Receptor Ligand Binding Domain in Complex with 5-(2-Fluoro-4-Hydroxyphenyl)-1-Methyl-1H-Pyrrole-2- Carbonitrile
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5voe (F: 19) - Desgla-XAS195A Bound to Aptamer 11F7T
Other atoms:
Mg (2);
Ca (1);
Na (1);
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5vof (F: 19) - Desgla-XAS195A Bound to Aptamer 11F7T and Rivaroxaban
Other atoms:
Mg (2);
Ca (1);
Cl (1);
Na (1);
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5vp0 (F: 12) - Discovery of Clinical Candidate N-{(1S)-1-[3-Fluoro-4- (Trifluoromethoxy)Phenyl]-2-Methoxyethyl}-7-Methoxy-2-Oxo-2,3- Dihydropyrido[2,3-B]Pyrazine-4(1H)-Carboxamide (Tak-915), A Highly Potent, Selective, and Brain-Penetrating Phosphodiesterase 2A Inhibitor For the Treatment of Cognitive Disorders
Other atoms:
Mg (3);
Zn (3);
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5vp1 (F: 9) - Discovery of Clinical Candidate N-{(1S)-1-[3-Fluoro-4- (Trifluoromethoxy)Phenyl]-2-Methoxyethyl}-7-Methoxy-2-Oxo-2,3- Dihydropyrido[2,3-B]Pyrazine-4(1H)-Carboxamide (Tak-915), A Highly Potent, Selective, and Brain-Penetrating Phosphodiesterase 2A Inhibitor For the Treatment of Cognitive Disorders
Other atoms:
Mg (4);
Zn (3);
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5vpm (F: 2) - Crystal Structure of Human Renin in Complex with A Biphenylpipderidinylcarbinol
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5vpt (F: 3) - 2009 H1N1 Pa Endonuclease in Complex with Ro-7
Other atoms:
Mn (2);
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5vpx (F: 3) - I38T Mutant of 2009 H1N1 Pa Endonuclease in Complex with Ro-7
Other atoms:
Mn (2);
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5vqe (F: 1) - Beta-Glucoside Phosphorylase Bglx Bound to 2FGLC
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5vqk (F: 1) - X-Ray Co-Structure of Nuclear Receptor Ror-Gammat Ligand Binding Domain with A Inverse Agonist and SRC2 Peptide
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5vqn (F: 3) - E119D Mutant of 2009 H1N1 Pa Endonuclease in Complex with Ro-7
Other atoms:
Mn (2);
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5vqq (F: 1) - Crystal Structure of Hiv-1 Reverse Transcriptase in Complex with N-(6- Cyano-3-(2-(2-(2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-Yl)Ethoxy) Phenoxy)-4-Methylnaphthalen-1-Yl)-2-Fluoro-N-Methylacetamide (JLJ683), A Non-Nucleoside Inhibitor
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5vqu (F: 1) - Crystal Structure of Hiv-1 Reverse Transcriptase (Y181C) Variant in Complex with N-(6-Cyano-3-(2-(2-(2,4-Dioxo-3,4-Dihydropyrimidin- 1(2H)-Yl)Ethoxy)Phenoxy)-4-Methylnaphthalen-1-Yl)-2-Fluoro-N- Methylacetamide (JLJ683), A Non-Nucleoside Inhibitor
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5vr4 (F: 4) - Rna Octamer Containing 2'-F-4'-Ome U.
Other atoms:
Co (1);
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5vr7 (F: 1) - Aba-Mimicking Ligand AMF1ALPHA in Complex with Aba Receptor PYL2 and PP2C HAB1
Other atoms:
Mg (2);
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5vrj (F: 3) - 2009 H1N1 Pa Endonuclease in Complex with Ro-7 and Magnesium
Other atoms:
Mg (2);
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5vrl (F: 3) - Crystal Structure of the Inha From Mycobacterium Tuberculosis in Complex with AN12855, Ebsi 4333.
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5vrm (F: 9) - Crystal Structure of the Inha From Mycobacterium Tuberculosis in Complex with AN12855, Ebsi 4333.
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5vro (F: 1) - Aba-Mimicking Ligand AMF1BETA in Complex with Aba Receptor PYL2 and PP2C HAB1
Other atoms:
Mg (3);
Page generated: Tue Dec 1 09:26:00 2020
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