Fluorine in PDB, part 190 (files: 7561-7600),
PDB 7k2u-7km9
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: 7561-7600 (PDB 7k2u-7km9).
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7k2u (F: 3) - Dhodh in Complex with Ligand 13
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7k4d (F: 15) - Cryo-Em Structure of Human TRPV6 in Complex with (4- Phenylcyclohexyl)Piperazine Inhibitor 3OG
Other atoms:
Ca (2);
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7k4f (F: 15) - Cryo-Em Structure of Human TRPV6 in Complex with (4- Phenylcyclohexyl)Piperazine Inhibitor 31
Other atoms:
Ca (1);
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7k5e (F: 6) - 1.75 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor Jag-5-7
Other atoms:
K (3);
Fe (7);
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7k5m (F: 6) - Crystal Structure of Hbv Capsid Y132A Mutant in Complex with N-(3- Chloro-4-Fluorophenyl)-3-Phenyl-1,4,6,7-Tetrahydro-5H-Pyrazolo[4,3- C]Pyridine-5-Carboxamide at 2.65A Resolution
Other atoms:
Cl (6);
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7k6a (F: 3) - Crystal Structure of Dihydrofolate Reductase (Dhfr) From Mycobacterium Ulcerans AGY99 in Complex with Nadp and Inhibitor Sddc-0001575
Other atoms:
Cl (1);
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7k6l (F: 2) - Carbonic Anhydrase II Complexed with 4-(2-(3-(4-Fluorophenyl)Ureido) Ethylsulfonamido)Benzenesulfonamide
Other atoms:
Zn (1);
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7k6m (F: 3) - Crystal Structure of PI3KALPHA Selective Inhibitor Pf-06843195
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7k6z (F: 1) - Carbonic Anhydrase IX Mimic Complexed with 4-(2-(3-(4-Fluorophenyl) Ureido)Ethylsulfonamido)Benzenesulfonamide
Other atoms:
Zn (1);
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7k77 (F: 3) - The Crystal Structure of the 2009 H1N1 Pa Endonuclease Mutant I38T in Complex with SJ001008025
Other atoms:
Mn (2);
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7k87 (F: 2) - The Crystal Structure of the 2009 H1N1 Pa Endonuclease in Complex with SJ000986436
Other atoms:
Mn (2);
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7k89 (F: 2) - Crystal Structure of Bovine RPE65 in Complex with 4-Fluoro-Emixustat and Palmitate
Other atoms:
Fe (2);
Na (2);
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7k8g (F: 2) - Crystal Structure of Bovine RPE65 in Complex with 4-Fluoro-Mb-004 and Palmitate
Other atoms:
Fe (2);
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7ka1 (F: 3) - 1.60 Angstrom Resolution Crystal Structure of the Beta-Q114A Mutant Tryptophan Synthase in Complex with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Alpha-Site, Aminoacrylate at the Beta Site, and Cesium Ion at the Metal Coordination Site
Other atoms:
Cl (5);
Cs (3);
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7kaf (F: 2) - The Crystal Structure of the 2009/H1N1/California Pa Endonuclease I38T (Construct with Truncated Loop 51-72) in Complex with Baloxavir Acid
Other atoms:
Mn (2);
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7kbc (F: 2) - The Crystal Structure of the 2009/H1N1/California Pa Endonuclease Mutant E119D (Construct with Truncated Loop 51-72) in Complex with Baloxavir Acid
Other atoms:
Mn (2);
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7kbg (F: 3) - Structure of Human HDAC2 in Complex with A 2-Substituted Benzamide Inhibitor (Compound 20)
Other atoms:
Ca (6);
Zn (3);
Cl (2);
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7kbn (F: 3) - 1.60 Angstrom Resolution Crystal Structure of the Beta-Q114A Mutant of Tryptophan Synthase in Complex with N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site, Cesium Ion at the Metal Coordination Site, and 2-Aminophenol Quinonoid at the Enzyme Beta Site
Other atoms:
Cs (4);
Cl (8);
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7kcb (F: 12) - Symmetry in Yeast Alcohol Dehydrogenase 1 -Closed Form with Nad+ and Trifluoroethanol
Other atoms:
Zn (8);
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7kdp (F: 18) - Hcmv Prefusion Gb in Complex with Fusion Inhibitor Way-174865
Other atoms:
Ca (1);
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7kh6 (F: 3) - 1.45 Angstrom Resolution Internal Aldimine Crystal Structure of the Beta-Q114A Mutant of Tryptophansynthase in Complex with N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site and Cesium Ion at the Metal Coordination Site
Other atoms:
Cl (3);
Cs (4);
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7khg (F: 3) - Crystal Structure of Kit Kinase Domain with A Small Molecule Inhibitor, PLX3397
Other atoms:
Cl (1);
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7khh (F: 2) - Ternary Complex of Vhl/BRD4-BD1/COMPOUND9 (4-(3,5-Difluoropyridin-2- Yl)-N-(11-(((S)-1-((2S,4R)-4-Hydroxy-2-((4-(4-Methylthiazol-5-Yl) Benzyl)Carbamoyl)Pyrrolidin-1-Yl)-3,3-Dimethyl-1-Oxobutan-2-Yl) Amino)-11-Oxoundecyl)-10-Methyl-7-((Methylsulfonyl)Methyl)-11-Oxo-3, 4,10,11-Tetrahydro-1H-1,4,10-Triazadibenzo[Cd,F]Azulene-6- Carboxamide)
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7khl (F: 2) - BRD4-BD1 COMPOUND6 (Methyl 4-(3,5-Difluoropyridin-2-Yl)-10-Methyl-7- ((Methylsulfonyl)Methyl)-11-Oxo-3,4,10,11-Tetrahydro-1H-1,4,10- Triazadibenzo[Cd,F]Azulene-6-Carboxylate)
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7ki7 (F: 3) - The External Aldimine Crystal Structure of the Beta-K167T Mutant Tryptophan Synthase at 1.75 Angstrom Resolution in Complex with N- (4'-Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site and Cesium Ion at the Metal Coordination Site
Other atoms:
Cs (3);
Cl (11);
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7kid (F: 3) - PRMT5:MEP50 Complexed with 5,5-Bicyclic Inhibitor Compound 72
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7kjs (F: 2) - Crystal Structure of CDK2/Cyclin E in Complex with Pf-06873600
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7kjw (F: 3) - Structure of Hiv-1 Reverse Transcriptase Initiation Complex Core with Efavirenz
Other atoms:
Mg (1);
Cl (1);
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7kk3 (F: 8) - Structure of the Catalytic Domain of PARP1 in Complex with Talazoparib
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7kk4 (F: 2) - Structure of the Catalytic Domain of PARP1 in Complex with Olaparib
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7kk8 (F: 1) - Fluoride Channel Fluc-EC2 Mutant S81T with Bromide
Other atoms:
Br (2);
Na (1);
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7kka (F: 2) - Fluoride Channel Fluc-EC2 Mutant S81A with Bromide
Other atoms:
Na (1);
Br (2);
-
7kkb (F: 2) - Fluoride Channel Fluc-EC2 Mutant S81C with Bromide
Other atoms:
Br (2);
Na (1);
-
7kkh (F: 2) - P1A4 Fab in Complex with ARS1620
Other atoms:
Cl (1);
Na (2);
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7kkn (F: 8) - Structure of the Catalytic Domain of Tankyrase 1 in Complex with Talazoparib
Other atoms:
Zn (4);
-
7kko (F: 3) - Structure of the Catalytic Domain of Tankyrase 1 in Complex with Olaparib
Other atoms:
Zn (3);
-
7kle (F: 1) - Ternary Structure of DPO4 Bound to N7MG in the Template Base Paired with Incoming Dctp
Other atoms:
Ca (3);
-
7km7 (F: 2) - Crystal Structure of Dihydrofolate Reductase (Dhfr) From Mycobacterium Ulcerans AGY99 in Complex with Nadp and Inhibitor Sddc-0001914, Tetragonal Crystal From
Other atoms:
Br (2);
-
7km8 (F: 4) - Crystal Structure of Dihydrofolate Reductase (Dhfr) From Mycobacterium Ulcerans AGY99 in Complex with Nadp and Inhibitor Sddc-0001914, Orthorhombic Crystal From
Other atoms:
Cl (4);
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7km9 (F: 2) - Crystal Structure of Dihydrofolate Reductase (Dhfr) From Mycobacterium Ulcerans AGY99 in Complex with Nadp and Inhibitor Sddc-0001913, Tetragonal Crystal From
Other atoms:
Br (2);
Cl (1);
Page generated: Thu Dec 28 04:16:24 2023
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