Ligand: FP4

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 3PRIA
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 3PRIA P15056 448 723 766.0 FP4:727 Type1 Inactive DFGin 6.2148 14.1271 BLAminus -135.2, 167.28 72.88, 95.66 -113.67, 26.28 291.49, 68.16 -64.26, -12.29 in-in in 7.8194 Saltbr-in 3.2365 HRD-in -75.89, -45.29 67.83, 4.74 in-in-out SNCiio in-out ActLoopNT-in 2.9193 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooo APE10-dihe-na 176.55, 160.69 APE9-dihe-na -174.14, 132.32 APE8-dihe-in -103.13, 129.4 APE8-rot-in 329.91 APE67-dihe-in -52.17, -13.03 -124.84, -28.03 APE12-dist-none 999.0 APE11-dist-out 15.4407 APE10-dist-out 11.7203 APE9-dist-out 9.456 None None None XRAY 3.5 0.245 0.303 A 307.0 264.0 12 30 18 12 [[457, 716]] 1.0 3pri 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 3PRIB P15056 448 723 766.0 FP4:727 Type1 Inactive DFGin 6.2755 14.1194 BLAminus -135.51, 166.8 73.87, 93.46 -111.51, 27.64 290.87, 67.31 -64.08, -14.39 in-in in 7.8435 Saltbr-in 3.1983 HRD-in -77.37, -41.63 65.39, 3.71 in-in-out SNCiio in-out ActLoopNT-in 2.9258 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooo APE10-dihe-na 175.7, 161.19 APE9-dihe-na -175.35, 132.33 APE8-dihe-in -100.79, 127.95 APE8-rot-in 333.36 APE67-dihe-in -51.21, -11.34 -122.71, -29.84 APE12-dist-none 999.0 APE11-dist-out 15.4442 APE10-dist-out 11.6993 APE9-dist-out 9.4303 None None None XRAY 3.5 0.245 0.303 B 307.0 264.0 12 30 18 12 [[457, 716]] 1.0 3pri 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: FP4

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 3PRIA
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 3PRIA P15056 448 723 766.0 FP4:727 Type1 Inactive DFGin 6.2148 14.1271 BLAminus -135.2, 167.28 72.88, 95.66 -113.67, 26.28 291.49, 68.16 -64.26, -12.29 in-in in 7.8194 Saltbr-in 3.2365 HRD-in -75.89, -45.29 67.83, 4.74 in-in-out SNCiio in-out ActLoopNT-in 2.9193 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooo APE10-dihe-na 176.55, 160.69 APE9-dihe-na -174.14, 132.32 APE8-dihe-in -103.13, 129.4 APE8-rot-in 329.91 APE67-dihe-in -52.17, -13.03 -124.84, -28.03 APE12-dist-none 999.0 APE11-dist-out 15.4407 APE10-dist-out 11.7203 APE9-dist-out 9.456 None None None XRAY 3.5 0.245 0.303 A 307.0 264.0 12 30 18 12 [[457, 716]] 1.0 3pri 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 3PRIB P15056 448 723 766.0 FP4:727 Type1 Inactive DFGin 6.2755 14.1194 BLAminus -135.51, 166.8 73.87, 93.46 -111.51, 27.64 290.87, 67.31 -64.08, -14.39 in-in in 7.8435 Saltbr-in 3.1983 HRD-in -77.37, -41.63 65.39, 3.71 in-in-out SNCiio in-out ActLoopNT-in 2.9258 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooo APE10-dihe-na 175.7, 161.19 APE9-dihe-na -175.35, 132.33 APE8-dihe-in -100.79, 127.95 APE8-rot-in 333.36 APE67-dihe-in -51.21, -11.34 -122.71, -29.84 APE12-dist-none 999.0 APE11-dist-out 15.4442 APE10-dist-out 11.6993 APE9-dist-out 9.4303 None None None XRAY 3.5 0.245 0.303 B 307.0 264.0 12 30 18 12 [[457, 716]] 1.0 3pri 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: FP4

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