Ligand: H7O

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 2 66.7% 9EWTA
DFGin BLAminus 1 33.3% 7DHKA
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
CMGC DYRK2 DYRK2_HUMAN 7DHKA Q92630 215 538 601.0 H7O:601 Type1 Inactive DFGin 7.0516 15.3496 BLAminus -117.35, 177.72 56.81, 75.07 -85.18, 19.92 283.41, 63.05 -63.85, -33.36 in-in in 9.1962 Saltbr-in 2.644 HRD-in -71.37, -46.63 75.15, -1.94 in-in-out SNCiio in-out ActLoopNT-in 2.9058 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -118.3, 166.48 APE9-dihe-na 68.65, 147.66 APE8-dihe-in -62.61, 137.42 APE8-rot-out 200.1 APE67-dihe-in -57.5, -27.74 -53.83, -48.57 APE12-dist-in 12.9551 APE11-dist-in 11.7375 APE10-dist-in 7.5928 APE9-dist-in 3.202 None PTR382,SEP458 PTR382,SEP458 XRAY 2.341 0.199 0.257 A 324.0 324.0 0 25 25 0 [[222, 535]] 1.0 7dhk CMGC_DYRK2_HUMAN CMGC 5.4e-99 337.1 1.0 301.0 301.0 367 368 369 371 373 251 266 270 345 347 346 348.0 404 392 387 386 385 384 383 382 381 302 Dual specificity tyrosine-phosphorylation-regulated kinase 2
TYR EGFR EGFR_HUMAN 9EWTA P00533 703 984 1210.0 A1H7O:61101 Type1.5_Back Inactive DFGin 7.5199 13.282 BLBplus -126.22, 168.9 67.49, 27.27 -77.28, 137.19 37.5, 85.6 57.97, 18.29 out-out out 16.0629 Saltbr-out 16.7741 HRD-in -64.15, -44.83 71.6, -39.03 out-out-out SNCooo out-out ActLoopNT-out 6.1319 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 121.93 APE8-dihe-in -66.6, 94.08 APE8-rot-na 23.81 APE67-dihe-in -68.36, -26.48 -72.94, -33.2 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.4546 V948R None None XRAY 3.019 0.238 0.342 A 332.0 270.0 12 30 18 12 [[712, 970]] 1.0 9ewt TYR_EGFR_HUMAN TYR 1.2e-85 293.0 3.0 259.0 257.0 854 855 856 858 860 745 762 766 834 836 835 837.0 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 9EWTB P00533 703 984 1210.0 A1H7O:61101 Type1.5_Back Inactive DFGin 7.4797 12.4171 BLBplus -127.27, 169.71 57.86, 28.37 -72.42, 129.96 42.21, 100.6 74.66, -18.63 out-out out 15.1762 Saltbr-out 16.3308 HRD-in -58.87, -43.22 64.98, -9.53 out-out-none SNCoon out-none ActLoopNT-out 6.2087 ActLoopCT-none TYR APEdihe_nniai APEdist_aaai APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 129.78 APE8-dihe-in -75.53, 79.59 APE8-rot-na 28.36 APE67-dihe-in -57.45, -45.92 -56.17, -38.9 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 7.5047 V948R None None XRAY 3.019 0.238 0.342 B 332.0 270.0 12 30 18 12 [[712, 970]] 1.0 9ewt TYR_EGFR_HUMAN TYR 1.2e-85 293.0 3.0 259.0 257.0 854 855 856 858 860 745 762 766 834 836 835 837.0 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor

Ligand: H7O

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 2 66.7% 9EWTA
DFGin BLAminus 1 33.3% 7DHKA
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
CMGC DYRK2 DYRK2_HUMAN 7DHKA Q92630 215 538 601.0 H7O:601 Type1 Inactive DFGin 7.0516 15.3496 BLAminus -117.35, 177.72 56.81, 75.07 -85.18, 19.92 283.41, 63.05 -63.85, -33.36 in-in in 9.1962 Saltbr-in 2.644 HRD-in -71.37, -46.63 75.15, -1.94 in-in-out SNCiio in-out ActLoopNT-in 2.9058 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -118.3, 166.48 APE9-dihe-na 68.65, 147.66 APE8-dihe-in -62.61, 137.42 APE8-rot-out 200.1 APE67-dihe-in -57.5, -27.74 -53.83, -48.57 APE12-dist-in 12.9551 APE11-dist-in 11.7375 APE10-dist-in 7.5928 APE9-dist-in 3.202 None PTR382,SEP458 PTR382,SEP458 XRAY 2.341 0.199 0.257 A 324.0 324.0 0 25 25 0 [[222, 535]] 1.0 7dhk Homo sapiens CMGC_DYRK2_HUMAN CMGC 5.4e-99 337.1 1.0 301.0 301.0 367 368 369 371 373 251 266 270 345 347 346 348.0 404 392 387 386 385 384 383 382 381 302 Dual specificity tyrosine-phosphorylation-regulated kinase 2
TYR EGFR EGFR_HUMAN 9EWTA P00533 703 984 1210.0 A1H7O:61101 Type1.5_Back Inactive DFGin 7.5199 13.282 BLBplus -126.22, 168.9 67.49, 27.27 -77.28, 137.19 37.5, 85.6 57.97, 18.29 out-out out 16.0629 Saltbr-out 16.7741 HRD-in -64.15, -44.83 71.6, -39.03 out-out-out SNCooo out-out ActLoopNT-out 6.1319 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 121.93 APE8-dihe-in -66.6, 94.08 APE8-rot-na 23.81 APE67-dihe-in -68.36, -26.48 -72.94, -33.2 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 8.4546 V948R None None XRAY 3.019 0.238 0.342 A 332.0 270.0 12 30 18 12 [[712, 970]] 1.0 9ewt Homo sapiens TYR_EGFR_HUMAN TYR 1.2e-85 293.0 3.0 259.0 257.0 854 855 856 858 860 745 762 766 834 836 835 837.0 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 9EWTB P00533 703 984 1210.0 A1H7O:61101 Type1.5_Back Inactive DFGin 7.4797 12.4171 BLBplus -127.27, 169.71 57.86, 28.37 -72.42, 129.96 42.21, 100.6 74.66, -18.63 out-out out 15.1762 Saltbr-out 16.3308 HRD-in -58.87, -43.22 64.98, -9.53 out-out-none SNCoon out-none ActLoopNT-out 6.2087 ActLoopCT-none TYR APEdihe_nniai APEdist_aaai APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 129.78 APE8-dihe-in -75.53, 79.59 APE8-rot-na 28.36 APE67-dihe-in -57.45, -45.92 -56.17, -38.9 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-in 7.5047 V948R None None XRAY 3.019 0.238 0.342 B 332.0 270.0 12 30 18 12 [[712, 970]] 1.0 9ewt Homo sapiens TYR_EGFR_HUMAN TYR 1.2e-85 293.0 3.0 259.0 257.0 854 855 856 858 860 745 762 766 834 836 835 837.0 896 884 879 878 877 876 875 874 873 791 Epidermal growth factor receptor

Ligand: H7O

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