Ligand: TV4

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 2 100.0% 3TV4B
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
TKL BRAF BRAF_HUMAN 3TV4A P15056 448 723 766.0 TV4:1 Type1.5_Back Inactive DFGin 5.402 13.6965 BLAplus -142.83, -171.49 46.74, 47.2 -119.19, -6.43 69.26, 117.52 -75.58, 165.81 out-out out 12.0327 Saltbr-out 11.3133 HRD-in -68.61, -47.44 76.91, -23.27 out-out-out SNCooo out-out ActLoopNT-out 9.0642 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nnoo APE10-dihe-na 999.0, -82.49 APE9-dihe-na -79.94, 51.24 APE8-dihe-out -152.88, 1.97 APE8-rot-in 289.52 APE67-dihe-in -59.4, -38.95 -39.48, -42.55 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 16.8815 APE9-dist-out 10.4785 None None None XRAY 3.4 0.244 0.307 A 307.0 264.0 12 30 20 10 [[457, 716]] 1.0 3tv4 TKL_BRAF_HUMAN TKL 1.1e-81 280.3 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 3TV4B P15056 448 723 766.0 TV4:1 Type1.5_Back Inactive DFGin 5.4527 13.6954 BLAplus -121.56, -159.18 14.55, 74.26 -129.62, -2.38 64.64, 122.32 -64.07, -82.37 out-out out 11.6272 Saltbr-out 10.5933 HRD-in -79.62, -54.84 87.21, -27.02 out-out-out SNCooo out-out ActLoopNT-out 8.5709 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iooo APE10-dihe-na -77.3, -34.85 APE9-dihe-na -85.7, 48.56 APE8-dihe-out -160.1, -10.48 APE8-rot-in 291.93 APE67-dihe-in -59.37, -49.79 -52.97, -39.23 APE12-dist-in 10.7753 APE11-dist-out 14.2745 APE10-dist-out 17.9903 APE9-dist-out 10.2564 None None None XRAY 3.4 0.244 0.307 B 307.0 276.0 0 30 30 0 [[457, 716]] 1.0 3tv4 TKL_BRAF_HUMAN TKL 1.1e-81 280.3 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf

Ligand: TV4

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 2 100.0% 3TV4B
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
TKL BRAF BRAF_HUMAN 3TV4A P15056 448 723 766.0 TV4:1 Type1.5_Back Inactive DFGin 5.402 13.6965 BLAplus -142.83, -171.49 46.74, 47.2 -119.19, -6.43 69.26, 117.52 -75.58, 165.81 out-out out 12.0327 Saltbr-out 11.3133 HRD-in -68.61, -47.44 76.91, -23.27 out-out-out SNCooo out-out ActLoopNT-out 9.0642 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nnoo APE10-dihe-na 999.0, -82.49 APE9-dihe-na -79.94, 51.24 APE8-dihe-out -152.88, 1.97 APE8-rot-in 289.52 APE67-dihe-in -59.4, -38.95 -39.48, -42.55 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 16.8815 APE9-dist-out 10.4785 None None None XRAY 3.4 0.244 0.307 A 307.0 264.0 12 30 20 10 [[457, 716]] 1.0 3tv4 Homo sapiens TKL_BRAF_HUMAN TKL 1.1e-81 280.3 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf
TKL BRAF BRAF_HUMAN 3TV4B P15056 448 723 766.0 TV4:1 Type1.5_Back Inactive DFGin 5.4527 13.6954 BLAplus -121.56, -159.18 14.55, 74.26 -129.62, -2.38 64.64, 122.32 -64.07, -82.37 out-out out 11.6272 Saltbr-out 10.5933 HRD-in -79.62, -54.84 87.21, -27.02 out-out-out SNCooo out-out ActLoopNT-out 8.5709 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iooo APE10-dihe-na -77.3, -34.85 APE9-dihe-na -85.7, 48.56 APE8-dihe-out -160.1, -10.48 APE8-rot-in 291.93 APE67-dihe-in -59.37, -49.79 -52.97, -39.23 APE12-dist-in 10.7753 APE11-dist-out 14.2745 APE10-dist-out 17.9903 APE9-dist-out 10.2564 None None None XRAY 3.4 0.244 0.307 B 307.0 276.0 0 30 30 0 [[457, 716]] 1.0 3tv4 Homo sapiens TKL_BRAF_HUMAN TKL 1.1e-81 280.3 4.0 266.0 263.0 593 594 595 597 599 483 501 505 573 575 574 576.0 638 623 618 617 616 615 614 613 612 530 Serine/threonine-protein kinase B-raf

Ligand: TV4

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