Fluorine in PDB, part 79 (files: 3121-3160),
PDB 4q0e-4qrc
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: 3121-3160 (PDB 4q0e-4qrc).
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4q0e (F: 5) - Crystal Structure of Ts-Dhfr From Cryptosporidium Hominis in Complex with Nadph, Fdump and 2-Amino-4-Oxo-4,7-Dihydro-Pyrrolo[2,3- D]Pyrimidine-Methyl-Phenyl-L-Glutamic Acid.
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4q0l (F: 15) - Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Other atoms:
Zn (4);
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4q1d (F: 2) - Human Dck C4S-S74E Mutant in Complex with Udp and the Inhibitor 9 {2- {[(1R)-1-{2-[3-(2-Fluoroethoxy)-4-Methoxyphenyl]-5-Propyl-1,3- Thiazol-4-Yl}Ethyl]Sulfanyl}Pyrimidine-4,6-Diamine}
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4q1e (F: 4) - Human Dck C4S-S74E Mutant in Complex with Udp and the Inhibitor 10 {2- {[(1R/S)-1-{2-[3-(2-Fluoroethoxy)-4-Methoxyphenyl]-5-Methyl-1,3- Thiazol 4-Yl}Ethyl]Sulfanyl}Pyrimidine-4,6-Diamine}
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4q3k (F: 2) - Crystal Structure of Mgs-M1, An Alpha/Beta Hydrolase Enzyme From A Medee Basin Deep-Sea Metagenome Library
Other atoms:
Cl (2);
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4q7b (F: 1) - Human Aldose Reductase Complexed with A Ligand with An Idd Structure ([2-(Benzylcarbamoyl)-5-Fluorophenoxy]Acetic Acid) at 1.19 A
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4q83 (F: 3) - Crystal Structure of 1-Hydroxy-3-(Trifluoromethyl)Pyridine-2(1H)- Thione Bound to Human Carbonic Anhydrase II
Other atoms:
Hg (1);
Zn (1);
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4q87 (F: 3) - Crystal Structure of 1-Hydroxy-4-(Trifluoromethyl)Pyridine-2(1H)- Thione Bound to Human Carbonic Anhydrase II
Other atoms:
Hg (1);
Zn (1);
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4q8x (F: 6) - Crystal Structure of 1-Hydroxy-5-(Trifluoromethyl)Pyridine-2(1H)- Thione Bound to Human Carbonic Anhydrase II
Other atoms:
Hg (1);
Zn (1);
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4q9r (F: 5) - Crystal Structure of An Rna Aptamer Bound to Trifluoroethyl-Ligand Analog in Complex with Fab
Other atoms:
K (1);
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4qab (F: 30) - X-Ray Structure of Acetylcholine Binding Protein (Achbp) in Complex with 4-(Morpholin-4-Yl)-6-[4-(Trifluoromethyl)Phenyl]Pyrimidin-2- Amine
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4qac (F: 30) - X-Ray Structure of Acetylcholine Binding Protein (Achbp) in Complex with 4-(4-Methylpiperidin-1-Yl)-6-(4-(Trifluoromethyl)Phenyl) Pyrimidin-2-Amine
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4qbj (F: 3) - Crystal Structure of N-Myristoyl Transferase From Aspergillus Fumigatus Comlexed with A Synthetic Inhibitor
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4qbx (F: 1) - Human Aldose Reductase Complexed with A Ligand with An Idd Structure ({5-Fluoro-2-[(3-Nitrobenzyl)Carbamoyl]Phenoxy}Acetic Acid) at 0.98 A
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4qga (F: 2) - S.Aureus Tmk in Complex with Potent Inhibitor Compound 19, 2-(3- Chlorophenoxy)-3-Fluoro-4-{[(3S)-3-(5-Methyl-2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Piperidin-1-Yl]Methyl}Benzoic Acid
Other atoms:
Cl (2);
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4qgg (F: 2) - Tmk in Complex with Compound 46, 2-(3-Chlorophenoxy)-3-Fluoro-4-{(1R)- 3-Methyl-1-[(3S)-3-(5-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)- Yl)Piperidin-1-Yl]Butyl}Benzoic Acid
Other atoms:
Cl (2);
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4qgh (F: 2) - S.Aureus Tmk in Complex with Potent Inhibitor Compound 47
Other atoms:
Cl (2);
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4qin (F: 2) - Structure of the Human Smoothened Receptor in Complex with SAG1.5
Other atoms:
Cl (1);
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4qiy (F: 12) - Crystal Structure of Human Carbonic Anhydrase Isozyme II with Inhibitor
Other atoms:
Zn (4);
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4qiz (F: 6) - Crystal Structure of Human Carbonic Anhydrase Isozyme XIII with Inhibitor
Other atoms:
Zn (2);
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4qj0 (F: 15) - Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Other atoms:
Zn (4);
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4qj3 (F: 4) - Structure of A Fragment of Human Phospholipase C-BETA3 DELTA472-559, in Complex with Galphaq
Other atoms:
Mg (1);
Al (1);
Ca (1);
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4qj4 (F: 4) - Structure of A Fragment of Human Phospholipase C-BETA3 DELTA472-569, Bound to IP3 and in Complex with Galphaq
Other atoms:
Mg (1);
Al (1);
Ca (1);
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4qj5 (F: 4) - Structure of A Fragment of Human Phospholipase C-BETA3 DELTA472-581, Bound to IP3 and in Complex with Galphaq
Other atoms:
Mg (1);
Al (1);
Ca (1);
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4qjc (F: 3) - Human Dihydrofolate Reductase Ternary Complex with Nadph and Inhibitor 26 (N~6~-Methyl-N~6~-(3,4,5-Trifluorophenyl)Pyrido[2,3-D]Pyrimidine- 2,4,6-Triamine)
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4qjm (F: 3) - Crystal Structure of Human Carbonic Anhydrase Isozyme II with Inhibitor
Other atoms:
Zn (1);
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4qjo (F: 12) - Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Other atoms:
Zn (4);
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4qjp (F: 6) - Crystal Structure of Human Carbonic Anhydrase Isozyme XIII with Inhibitor
Other atoms:
Zn (2);
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4qjw (F: 15) - Crystal Structure of Catalytic Domain of Human Carbonic Anhydrase Isozyme XII with Inhibitor
Other atoms:
Zn (4);
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4qjx (F: 3) - Crystal Structure of Human Carbonic Anhydrase Isozyme XIII with Inhibitor
Other atoms:
Zn (1);
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4ql1 (F: 6) - Crystal Structure of Human WDR5 in Complex with Compound Oicr-9429
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4qmp (F: 2) - MST3 in Complex with CDK1/2 Inhibitor III, 5-Amino-3-{[4- (Aminosulfonyl)Phenyl]Amino}-N-(2,6-Difluorophenyl)-1H-1,2,4- Triazole-1-Carbothioamide
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4qmu (F: 2) - MST3 in Complex with Jnj-7706621, 4-({5-Amino-1-[(2,6-Difluorophenyl) Carbonyl]-1H-1,2,4-Triazol-3-Yl}Amino)Benzenesulfonamide
Other atoms:
Mg (1);
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4qmv (F: 3) - MST3 in Complex with Pf-03814735, N-{2-[(1S,4R)-6-{[4- (Cyclobutylamino)-5-(Trifluoromethyl)Pyrimidin-2-Yl]Amino}-1,2,3,4- Tetrahydro-1,4-Epiminonaphthalen-9-Yl]-2-Oxoethyl}Acetamide
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4qmz (F: 1) - MST3 in Complex with Sunitinib
Other atoms:
Cl (2);
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4qnq (F: 36) - Crystal Structure Analysis of Full-Length Bcl-Xl in Complex with the Inhibitor Abt-263
Other atoms:
Cl (12);
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4qpf (F: 1) - New Lower Bone Affinity Bisphosphonate Drug Design For Effective Use in Diseases Characterized By Abnormal Bone Resorption
Other atoms:
Mg (3);
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4qqe (F: 3) - Crystal Structure of WDR5, Wd Repeat Domain 5 in Complex with Compound Sgc-Ds-Mt-0345
Other atoms:
Cl (1);
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4qr6 (F: 1) - Human Aldose Reductase Complexed with A Ligand with An Idd Structure (2-[2-(1,3-Benzothiazol-2-Ylmethylcarbamoyl)-5-Fluoro-Phenoxy]Acetic Acid) at 1.05 A
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4qrc (F: 3) - Crystal Structure of the Tyrosine Kinase Domain of Fgf Receptor 4 in Complex with Ponatinib
Page generated: Thu Dec 28 04:04:23 2023
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