Ligand: 5WF

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 2 100.0% 5FBNC
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
TYR BTK BTK_HUMAN 5FBNC Q06187 395 658 659.0 5WF:701,5WE:702 Type1.5_Front,Allosteric Inactive DFGin 6.2343 13.4854 BLBplus -138.97, 172.93 64.41, 21.2 -64.91, 134.85 43.34, 89.93 78.28, -17.1 out-out out 15.0072 Saltbr-out 15.714 HRD-in -67.81, -54.89 86.66, -24.42 out-out-out SNCooo out-out ActLoopNT-out 8.1944 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out 143.31, -31.01 APE9-dihe-in -63.12, 135.49 APE8-dihe-in -76.38, 65.1 APE8-rot-na 32.35 APE67-dihe-in -72.98, -10.12 -50.46, -47.16 APE12-dist-na 999.0 APE11-dist-na 17.8308 APE10-dist-na 12.6083 APE9-dist-out 8.1809 None None None XRAY 1.8 0.182 0.226 C 271.0 256.0 8 29 21 8 [[402, 653]] 1.0 5fbn TYR_BTK_HUMAN TYR 6e-93 316.8 1.0 258.0 258.0 538 539 540 542 544 430 445 449 518 520 519 521.0 579 567 562 561 560 559 558 557 556 475 Tyrosine-protein kinase BTK
TYR BTK BTK_HUMAN 5FBND Q06187 394 658 659.0 5WF:702,5WE:703,5WE:704,5WE:705 Type1.5_Front,Allosteric,Allosteric,Allosteric Inactive DFGin 6.2504 13.4724 BLBplus -137.76, 172.64 65.66, 19.16 -62.24, 135.48 45.56, 88.91 74.32, -16.76 out-out out 15.0558 Saltbr-out 15.7515 HRD-in -65.32, -54.88 86.04, -26.38 out-out-none SNCoon out-none ActLoopNT-out 8.1947 ActLoopCT-none TYR APEdihe_nniai APEdist_aaai APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 136.18 APE8-dihe-in -78.24, 64.6 APE8-rot-na 31.95 APE67-dihe-in -74.36, -8.3 -50.81, -46.27 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 7.8979 None None None XRAY 1.8 0.182 0.226 D 271.0 255.0 10 29 19 10 [[402, 653]] 1.0 5fbn TYR_BTK_HUMAN TYR 6e-93 316.8 1.0 258.0 258.0 538 539 540 542 544 430 445 449 518 520 519 521.0 579 567 562 561 560 559 558 557 556 475 Tyrosine-protein kinase BTK

Ligand: 5WF

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 2 100.0% 5FBNC
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
TYR BTK BTK_HUMAN 5FBNC Q06187 395 658 659.0 5WF:701,5WE:702 Type1.5_Front,Allosteric Inactive DFGin 6.2343 13.4854 BLBplus -138.97, 172.93 64.41, 21.2 -64.91, 134.85 43.34, 89.93 78.28, -17.1 out-out out 15.0072 Saltbr-out 15.714 HRD-in -67.81, -54.89 86.66, -24.42 out-out-out SNCooo out-out ActLoopNT-out 8.1944 ActLoopCT-out TYR APEdihe_oiiai APEdist_aaao APE10-dihe-out 143.31, -31.01 APE9-dihe-in -63.12, 135.49 APE8-dihe-in -76.38, 65.1 APE8-rot-na 32.35 APE67-dihe-in -72.98, -10.12 -50.46, -47.16 APE12-dist-na 999.0 APE11-dist-na 17.8308 APE10-dist-na 12.6083 APE9-dist-out 8.1809 None None None XRAY 1.8 0.182 0.226 C 271.0 256.0 8 29 21 8 [[402, 653]] 1.0 5fbn Homo sapiens TYR_BTK_HUMAN TYR 6e-93 316.8 1.0 258.0 258.0 538 539 540 542 544 430 445 449 518 520 519 521.0 579 567 562 561 560 559 558 557 556 475 Tyrosine-protein kinase BTK
TYR BTK BTK_HUMAN 5FBND Q06187 394 658 659.0 5WF:702,5WE:703,5WE:704,5WE:705 Type1.5_Front,Allosteric,Allosteric,Allosteric Inactive DFGin 6.2504 13.4724 BLBplus -137.76, 172.64 65.66, 19.16 -62.24, 135.48 45.56, 88.91 74.32, -16.76 out-out out 15.0558 Saltbr-out 15.7515 HRD-in -65.32, -54.88 86.04, -26.38 out-out-none SNCoon out-none ActLoopNT-out 8.1947 ActLoopCT-none TYR APEdihe_nniai APEdist_aaai APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 136.18 APE8-dihe-in -78.24, 64.6 APE8-rot-na 31.95 APE67-dihe-in -74.36, -8.3 -50.81, -46.27 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 7.8979 None None None XRAY 1.8 0.182 0.226 D 271.0 255.0 10 29 19 10 [[402, 653]] 1.0 5fbn Homo sapiens TYR_BTK_HUMAN TYR 6e-93 316.8 1.0 258.0 258.0 538 539 540 542 544 430 445 449 518 520 519 521.0 579 567 562 561 560 559 558 557 556 475 Tyrosine-protein kinase BTK

Ligand: 5WF

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