Ligand: C5N

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 5O91A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

Group Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
OTHER TTK TTK_HUMAN 5MRBA P33981 519 795 857.0 C5N:60901 Type1 Inactive DFGin 3.9904 15.0552 ABAminus -88.14, -37.43 -145.51, 169.37 -114.29, 5.64 296.03, 167.61 72.21, 9.85 out-out out 11.2038 Saltbr-out 6.0746 HRD-in -67.77, -54.4 68.39, 11.32 out-out-out SNCooo out-out ActLoopNT-out 11.0039 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nooo APE10-dihe-na -119.93, 125.86 APE9-dihe-na 65.05, 26.68 APE8-dihe-in -57.09, 145.6 APE8-rot-out 189.99 APE67-dihe-in -63.9, -20.76 -103.43, 7.11 APE12-dist-none 999.0 APE11-dist-out 21.193 APE10-dist-out 18.5012 APE9-dist-out 10.5598 C604Y None None XRAY 2.2 0.175 0.216 A 313.0 259.0 18 30 25 5 [[525, 791]] 1.0 5mrb OTHER_TTK_HUMAN CAMK 5.7e-54 189.2 1.0 256.0 256.0 663 664 665 667 669 553 571 575 644 646 645 647.0 716 693 688 687 686 685 684 683 682 603 Dual specificity protein kinase TTK
OTHER TTK TTK_HUMAN 5O91A P33981 519 796 857.0 C5N:60901 Type1 Inactive DFGin 3.802 15.016 ABAminus -78.15, -40.0 -151.19, 165.46 -106.99, 8.04 304.83, 159.67 51.06, 36.71 out-out out 11.1062 Saltbr-out 6.4839 HRD-in -71.98, -51.24 56.1, 25.02 out-out-out SNCooo out-out ActLoopNT-out 11.3197 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nooo APE10-dihe-na -75.68, 72.2 APE9-dihe-na 66.53, 36.69 APE8-dihe-in -74.19, 134.73 APE8-rot-out 176.75 APE67-dihe-in -60.61, -35.71 -97.24, 8.51 APE12-dist-none 999.0 APE11-dist-out 17.7543 APE10-dist-out 18.9871 APE9-dist-out 10.2058 C604W None None XRAY 3.2 0.214 0.254 A 313.0 261.0 17 30 24 6 [[525, 791]] 1.0 5o91 OTHER_TTK_HUMAN CAMK 2.5e-53 187.1 1.0 256.0 256.0 663 664 665 667 669 553 571 575 644 646 645 647.0 716 693 688 687 686 685 684 683 682 603 Dual specificity protein kinase TTK

Ligand: C5N

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 5O91A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

Group Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Species Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name
OTHER TTK TTK_HUMAN 5MRBA P33981 519 795 857.0 C5N:60901 Type1 Inactive DFGin 3.9904 15.0552 ABAminus -88.14, -37.43 -145.51, 169.37 -114.29, 5.64 296.03, 167.61 72.21, 9.85 out-out out 11.2038 Saltbr-out 6.0746 HRD-in -67.77, -54.4 68.39, 11.32 out-out-out SNCooo out-out ActLoopNT-out 11.0039 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nooo APE10-dihe-na -119.93, 125.86 APE9-dihe-na 65.05, 26.68 APE8-dihe-in -57.09, 145.6 APE8-rot-out 189.99 APE67-dihe-in -63.9, -20.76 -103.43, 7.11 APE12-dist-none 999.0 APE11-dist-out 21.193 APE10-dist-out 18.5012 APE9-dist-out 10.5598 C604Y None None XRAY 2.2 0.175 0.216 A 313.0 259.0 18 30 25 5 [[525, 791]] 1.0 5mrb Homo sapiens OTHER_TTK_HUMAN CAMK 5.7e-54 189.2 1.0 256.0 256.0 663 664 665 667 669 553 571 575 644 646 645 647.0 716 693 688 687 686 685 684 683 682 603 Dual specificity protein kinase TTK
OTHER TTK TTK_HUMAN 5O91A P33981 519 796 857.0 C5N:60901 Type1 Inactive DFGin 3.802 15.016 ABAminus -78.15, -40.0 -151.19, 165.46 -106.99, 8.04 304.83, 159.67 51.06, 36.71 out-out out 11.1062 Saltbr-out 6.4839 HRD-in -71.98, -51.24 56.1, 25.02 out-out-out SNCooo out-out ActLoopNT-out 11.3197 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nooo APE10-dihe-na -75.68, 72.2 APE9-dihe-na 66.53, 36.69 APE8-dihe-in -74.19, 134.73 APE8-rot-out 176.75 APE67-dihe-in -60.61, -35.71 -97.24, 8.51 APE12-dist-none 999.0 APE11-dist-out 17.7543 APE10-dist-out 18.9871 APE9-dist-out 10.2058 C604W None None XRAY 3.2 0.214 0.254 A 313.0 261.0 17 30 24 6 [[525, 791]] 1.0 5o91 Homo sapiens OTHER_TTK_HUMAN CAMK 2.5e-53 187.1 1.0 256.0 256.0 663 664 665 667 669 553 571 575 644 646 645 647.0 716 693 688 687 686 685 684 683 682 603 Dual specificity protein kinase TTK

Ligand: C5N

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

Group Gene SwissprotID PDB UniprotID First_obs_res Last_obs_res Length_Unp Ligand Ligand_type Activity_label Spatial_label Phe_Glu4_dis Phe_Lys_dis Dihedral_label XDFG
φ,ψ		 DFG-Asp
φ,ψ		 DFG-Phe
φ,ψ		 DFG-Phe
χ1,χ2		 DFG-Gly
φ,ψ		 ChelixSaltbr_label Chelix_label Lys_Glu_dis Saltbr_label LysNZ_GluOE_dis HRD_label His φ,ψ Arg φ,ψ SNC_label SNCpymol_label ActLoop_label ActLoopNT_label DFG6_XHRD_dis ActLoopCT_label APEtype APEdihe_label APEdist_label APE10_dihe_label APE10 φ,ψ APE9_dihe_label APE9 φ,ψ APE8_dihe_label APE8 φ,ψ APE8_rotamer_label APE8 χ1 APE67_label APE6 φ,ψ APE7 φ,ψ APE12_dist_label APE12_DFG4_dis APE11_dist_label APE11_DFG4_dis APE10_dist_label APE10_DFG4_dis APE9_dist_label APE9_Arg_dis Chain_mut Chain_phos Modified_aa Method Resolution Rvalue FreeRvalue Chain_id ChainLen Ordered_residues DomainBreak ActLoopLength ActLoopResolvedResidues ActLoopDisorderedResidues Kinase_domains_Unp N_Kinase_domains_Unp pdb Species Kincore_name hmm Evalue Score hmmbeg hmmend hmmlen XDFGnum DFGnum PHEnum DFG4num DFG6num LYSnum GLUnum GLU4num XHRDnum ARGnum HRDnum HRDaspnum aFaspnum APEnum APE6num APE7num APE8num APE9num APE10num APE11num APE12num Hinge1num Protein_name