Ligand: 2VX

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% 4PP7B
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 4PP7A P15056 448 721 766.0 2VX:801 Type1.5_Back Inactive DFGin 5.0628 13.5504 BLAplus -144.36, -179.4 70.84, 11.79 -79.39, -18.32 64.06, 95.8 -64.87, 163.13 out-out out 11.8193 Saltbr-out 9.8983 HRD-in -60.94, -49.15 74.91, 0.91 out-out-out SNCooo out-out ActLoopNT-out 8.8818 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nooo APE10-dihe-na -161.63, 37.41 APE9-dihe-na -160.85, -8.39 APE8-dihe-out -110.61, 12.59 APE8-rot-in 299.45 APE67-dihe-in -61.85, -28.03 -37.74, -49.88 APE12-dist-none 999.0 APE11-dist-out 14.0738 APE10-dist-out 17.7305 APE9-dist-out 10.5871 None None None XRAY 3.4 0.198 0.254 A 307.0 267.0 7 30 23 7 [[457, 716]] 1.0 4pp7 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 4PP7B P15056 448 721 766.0 2VX:801 Type1.5_Back Inactive DFGin 5.5752 13.8553 BLAplus -143.27, -178.26 56.82, 45.93 -107.94, -13.37 54.78, 79.55 -65.66, 171.36 out-out out 11.418 Saltbr-out 10.5807 HRD-in -65.31, -43.62 75.45, -24.33 out-out-out SNCooo out-out ActLoopNT-out 8.5726 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iooo APE10-dihe-na -59.94, -29.73 APE9-dihe-na -89.39, 13.82 APE8-dihe-out -141.1, 5.05 APE8-rot-in 299.07 APE67-dihe-in -66.69, -31.17 -60.83, -30.61 APE12-dist-in 11.426 APE11-dist-out 15.016 APE10-dist-out 18.5333 APE9-dist-out 10.4519 None None None XRAY 3.4 0.198 0.254 B 307.0 274.0 0 30 30 0 [[457, 716]] 1.0 4pp7 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: 2VX

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% 4PP7B
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 4PP7A P15056 448 721 766.0 2VX:801 Type1.5_Back Inactive DFGin 5.0628 13.5504 BLAplus -144.36, -179.4 70.84, 11.79 -79.39, -18.32 64.06, 95.8 -64.87, 163.13 out-out out 11.8193 Saltbr-out 9.8983 HRD-in -60.94, -49.15 74.91, 0.91 out-out-out SNCooo out-out ActLoopNT-out 8.8818 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_nooo APE10-dihe-na -161.63, 37.41 APE9-dihe-na -160.85, -8.39 APE8-dihe-out -110.61, 12.59 APE8-rot-in 299.45 APE67-dihe-in -61.85, -28.03 -37.74, -49.88 APE12-dist-none 999.0 APE11-dist-out 14.0738 APE10-dist-out 17.7305 APE9-dist-out 10.5871 None None None XRAY 3.4 0.198 0.254 A 307.0 267.0 7 30 23 7 [[457, 716]] 1.0 4pp7 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 4PP7B P15056 448 721 766.0 2VX:801 Type1.5_Back Inactive DFGin 5.5752 13.8553 BLAplus -143.27, -178.26 56.82, 45.93 -107.94, -13.37 54.78, 79.55 -65.66, 171.36 out-out out 11.418 Saltbr-out 10.5807 HRD-in -65.31, -43.62 75.45, -24.33 out-out-out SNCooo out-out ActLoopNT-out 8.5726 ActLoopCT-out nonTYR APEdihe_aaoii APEdist_iooo APE10-dihe-na -59.94, -29.73 APE9-dihe-na -89.39, 13.82 APE8-dihe-out -141.1, 5.05 APE8-rot-in 299.07 APE67-dihe-in -66.69, -31.17 -60.83, -30.61 APE12-dist-in 11.426 APE11-dist-out 15.016 APE10-dist-out 18.5333 APE9-dist-out 10.4519 None None None XRAY 3.4 0.198 0.254 B 307.0 274.0 0 30 30 0 [[457, 716]] 1.0 4pp7 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: 2VX

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