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Chlorine in PDB, part 513 (files: 20481-20520), PDB 7kpt-7kza

Experimental structures of coordination spheres of Chlorine (Cl) in bioorganic molecules from X-Ray and NMR experiments. Coordination spheres were calculated with 5.0 Angstroms radius around Chlorine atoms. PDB files: 20481-20520 (PDB 7kpt-7kza).
  1. 7kpt (Cl: 1) - Crystal Structure of Ctde in Complex with Fad and Substrate 4
  2. 7kpy (Cl: 2) - Crystal Structure of Cbp Bromodomain Liganded with UMB298 (Compound 23)
  3. 7kq9 (Cl: 5) - The Aminoacrylate Form of the Beta-Q114A Mutant Tryptophan Synthase at 1.50 Angstrom Resolution with Cesium Ion at the Metal Coordination Site
    Other atoms: Br (1); Cs (4);
  4. 7kqf (Cl: 6) - The Internal Aldimine Form of the Wild-Type Tryptophan Synthase From Salmonella in Complex with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site and Cesium Ion at the Metal Coordination Site at 1.47 Angstrom Resolution
    Other atoms: Cs (6); F (3);
  5. 7krc (Cl: 1) - Crystal Structure of Hiv-1 Reverse Transcriptase in Complex with (E)- 4-(3-Chloro-5-(2-Cyanovinyl)Phenoxy)-3-(2-(2,4-Dioxo-3,4- Dihydropyrimidin-1(2H)-Yl)Ethoxy)Phenyl Sulfurofluoridate (JLJ709)
  6. 7krd (Cl: 1) - Crystal Structure of Hiv-1 Reverse Transcriptase in Complex with 4-(3- Chloro-5-Cyanophenoxy)-3-(2-(2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)- Yl)Ethoxy)Phenyl Sulfurofluoridate (JLJ702)
  7. 7krx (Cl: 2) - The Crystal Structure of Papain-Like Protease of Sars Cov-2, C111S Mutant, in Complex with PLP_SNYDER441
    Other atoms: Zn (4);
  8. 7ksi (Cl: 1) - Thiophenyl-Pyrazolourea Derivatives As Potent, Brian Penetrant, Orally Bioavailable, and Isoform-Selective JNK3 Inhibitors
    Other atoms: F (1);
  9. 7ksj (Cl: 1) - Thiophenyl-Pyrazolourea Derivatives As Potent, Brian Penetrant, Orally Bioavailable, and Isoform-Selective JNK3 Inhibitors
    Other atoms: F (1);
  10. 7ksk (Cl: 1) - Thiophenyl-Pyrazolourea Derivatives As Potent, Brian Penetrant, Orally Bioavailable, and Isoform-Selective JNK3 Inhibitors
  11. 7kss (Cl: 1) - Dna Polymerase Mu, Dgtp:Ct Pre-Catalytic Ground State Ternary Complex, 10 Mm CA2+ (20MIN)
    Other atoms: Ca (2); Na (2);
  12. 7ksw (Cl: 1) - Dna Polymerase Mu, Dgtp:Ct Reaction State Ternary Complex, 10 Mm MG2+ (10MIN)
    Other atoms: Na (1); Mg (3);
  13. 7kt0 (Cl: 1) - Dna Polymerase Mu, Dgtp:at Ground State Ternary Complex, 50 Mm MG2+ (60MIN)
    Other atoms: Na (1); Mg (2);
  14. 7kt1 (Cl: 1) - Dna Polymerase Mu, Dgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (180MIN)
    Other atoms: Na (1); Mn (6);
  15. 7kt3 (Cl: 3) - Dna Polymerase Mu, 8-Oxodgtp:at Pre-Catalytic Ground State Ternary Complex, 20 Mm CA2+ (120MIN)
    Other atoms: Na (1); Ca (3);
  16. 7kt4 (Cl: 2) - Dna Polymerase Mu, 8-Oxodgtp:at Reaction State Ternary Complex, 10 Mm MN2+ (30MIN)
    Other atoms: Na (1); Mn (4);
  17. 7kt5 (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:at Product State Ternary Complex, 10 Mm MN2+ (120MIN)
    Other atoms: Na (1); Mn (7);
  18. 7kt7 (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:at Reaction State Ternary Complex, 50 Mm MG2+ (60MIN)
    Other atoms: Mg (2); Na (1);
  19. 7kt8 (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:at Product State Ternary Complex, 50 Mm MG2+ (180MIN)
    Other atoms: Na (1); Mg (2);
  20. 7kt9 (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:at Product State Ternary Complex, 50 Mm MG2+ (960MIN)
    Other atoms: Na (2); Mg (1);
  21. 7kta (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:Ct Pre-Catalytic Ground State Ternary Complex, 20 Mm CA2+ (120MIN)
    Other atoms: Ca (2); Na (1);
  22. 7kte (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:Ct Reaction State Ternary Complex, 50 Mm MG2+ (90MIN)
    Other atoms: Mg (2); Na (1);
  23. 7ktg (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:Ct Product State Ternary Complex, 50 Mm MG2+ (960MIN)
    Other atoms: Mg (2); Na (1);
  24. 7kth (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:Ct Product State Ternary Complex, 10 Mm MG2+ (2160MIN)
    Other atoms: Mg (1); Na (2);
  25. 7ktj (Cl: 1) - Dna Polymerase Mu (K438D), 8-Oxodgtp:Ct Pre-Catalytic Ground State Ternary Complex, 20 Mm CA2+ (120MIN)
    Other atoms: Na (1); Ca (3);
  26. 7ktn (Cl: 1) - Dna Polymerase Mu, 8-Oxodgtp:at Product State Ternary Complex, 10 Mm MG2+ (2160MIN)
    Other atoms: Mg (1); Na (2);
  27. 7ku7 (Cl: 2) - Cryo-Em Structure of Rous Sarcoma Virus Cleaved Synaptic Complex (Csc) with Hiv-1 Integrase Strand Transfer Inhibitor Mk-2048. Cluster Identified By 3-Dimensional Variability Analysis in Cryosparc.
    Other atoms: F (2); Mg (4); Zn (2);
  28. 7ku9 (Cl: 3) - The Internal Aldimine Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase with Sodium Ion at the Metal Coordination Site, Two Molecules of F6F Inhibitor at the Enzyme Alpha-Site and Another F6F Molecule at the Enzyme Beta-Site at 1.40 Angstrom Resolution
    Other atoms: Na (1); F (9);
  29. 7kui (Cl: 2) - Cryo-Em Structure of Rous Sarcoma Virus Cleaved Synaptic Complex (Csc) with Hiv-1 Integrase Strand Transfer Inhibitor Mk-2048. Cic Region of A Cluster Identified By 3-Dimensional Variability Analysis in Cryosparc.
    Other atoms: Zn (2); F (2);
  30. 7kvl (Cl: 1) - Sars-Cov-2 Main Protease Immature Form - Fmax Library E01 Fragment
  31. 7kwv (Cl: 2) - The Aminoacrylate Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site and Cesium Ion at the Metal Coordination Site at 1.30 Angstrom Resolution
    Other atoms: Cs (3); F (3);
  32. 7kxc (Cl: 1) - The Aminoacrylate Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site, Sodium Ion at the Metal Coordination Site and Benzimidazole (Bzi) at the Enzyme Beta-Site at 1.30 Angstrom Resolution. One of the Beta-Q114 Rotamer Conformations Allows A Hydrogen Bond to Form with the Plp Oxygen at the Position 3 in the Ring
    Other atoms: Na (1); F (3);
  33. 7kxd (Cl: 2) - Crystal Structure of Rar-Related Orphan Receptor C (Nhis-Rorgt(244- 487)-L6-SRC1(678-692)) in Complex with {3,5-Dichloro-4-[4-Methoxy-3- (Propan-2-Yl)Phenoxy]Phenyl}Methanol
  34. 7kxe (Cl: 2) - Crystal Structure of Rar-Related Orphan Receptor C (Nhis-Rorgt(244- 487)-L6-SRC1(678-692)) in Complex with {3,5-Dichloro-4-[4-Methoxy-3- (Propan-2-Yl)Phenoxy]Phenyl}Methanol
  35. 7kxf (Cl: 2) - Crystal Structure of Rar-Related Orphan Receptor C (Nhis-Rorgt(244- 487)-L6-SRC1(678-692)) in Complex with {3,5-Dichloro-4-[4-Methoxy-3- (Propan-2-Yl)Phenoxy]Phenyl}Methanol
  36. 7kxz (Cl: 1) - Active Conformation of Egfr Kinase in Complex with Bi-4020
  37. 7kyf (Cl: 2) - Botulism Neurooxin Light Chain A App Form
    Other atoms: Zn (1);
  38. 7kyh (Cl: 8) - Botulism Neurooxin Light Chain A App Form
    Other atoms: Zn (4);
  39. 7kyl (Cl: 1) - Powassan Virus Envelope Protein Diii in Complex with Neutralizing Fab Powv-80
    Other atoms: Na (1);
  40. 7kza (Cl: 2) - Potent Sars-Cov-2 Binding and Neutralization Through Maturation of Iconic Sars-Cov-1ANTIBODIES
    Other atoms: Na (1);
Page generated: Thu Dec 28 02:55:01 2023

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