Ligand: I76

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 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

Ligand: I76

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 33.3% 4DGGB
DFGin BLBminus 1 33.3% 4DGGA
None None 1 33.3% 3V51A
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 SRC SRC_CHICK 4DGGB P00523 256 533 533.0 I76:601 Type1.5_Back Inactive DFGin 6.6122 15.5645 BLAminus -139.0, 162.57 58.54, 78.29 -80.96, 80.83 286.83, 69.82 61.95, 6.6 out-out out 12.9718 Saltbr-out 13.3244 HRD-in -76.75, -55.14 88.94, -27.53 out-out-out SNCooo out-out ActLoopNT-out 11.4323 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 87.99 APE8-dihe-in -80.3, 71.17 APE8-rot-na 34.3 APE67-dihe-in -66.28, -28.18 -71.13, -18.84 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 9.4737 None None None XRAY 2.65 0.21 0.252 B 286.0 259.0 19 29 16 13 [[267, 518]] 1.0 4dgg Gallus gallus TYR_SRC_CHICK TYR 3.4e-94 320.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 4DGGA P00523 256 533 533.0 I76:601 Type1.5_Front Inactive DFGin 7.1822 16.0519 BLBminus -138.93, 160.43 60.89, 77.08 -83.17, 130.88 289.59, 69.05 -67.2, 999.0 out-none out 12.5009 Saltbr-none 999.0 HRD-in -77.19, -53.85 87.04, -25.32 none-none-out SNCnno none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 148.96 APE8-dihe-in -89.03, 71.14 APE8-rot-na 37.27 APE67-dihe-in -65.17, -28.22 -72.82, -18.07 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 9.8555 None None None XRAY 2.65 0.21 0.252 A 286.0 261.0 17 29 12 17 [[267, 518]] 1.0 4dgg Gallus gallus TYR_SRC_CHICK TYR 3.4e-94 320.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
CAMK CDPK1 Q9BJF5_TOXGO 3V51A Q9BJF5 43 507 507.0 I76:701 Type1.5_Back Inactive None 11.621 17.4912 None -103.86, 156.43 80.51, 11.08 -55.27, 132.65 255.66, 102.13 88.39, -19.01 out-out out 14.2465 Saltbr-out 15.4138 HRD-in -87.55, -56.73 77.91, -30.08 out-out-out SNCooo out-out ActLoopNT-out 5.6018 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iooo APE10-dihe-na -53.66, 131.19 APE9-dihe-na 97.99, -20.38 APE8-dihe-out -74.28, -35.69 APE8-rot-out 57.07 APE67-dihe-in -66.67, -30.42 -63.26, -28.58 APE12-dist-in 13.7102 APE11-dist-out 15.908 APE10-dist-out 18.6445 APE9-dist-out 11.5911 None None None XRAY 1.95 0.199 0.234 A 484.0 459.0 0 27 27 0 [[51, 308]] 1.0 3v51 Toxoplasma gondii CAMK_CDPK1_TOXGO CAMK 4.6e-90 307.7 1.0 256.0 256.0 194 195 196 198 200 80 99 103 171 173 172 174.0 232 221 216 215 214 213 212 211 210 129 non-specific serine/threonine protein kinase

Ligand: I76

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 33.3% 4DGGB
DFGin BLBminus 1 33.3% 4DGGA
None None 1 33.3% 3V51A
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 SRC SRC_CHICK 4DGGB P00523 256 533 533.0 I76:601 Type1.5_Back Inactive DFGin 6.6122 15.5645 BLAminus -139.0, 162.57 58.54, 78.29 -80.96, 80.83 286.83, 69.82 61.95, 6.6 out-out out 12.9718 Saltbr-out 13.3244 HRD-in -76.75, -55.14 88.94, -27.53 out-out-out SNCooo out-out ActLoopNT-out 11.4323 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 87.99 APE8-dihe-in -80.3, 71.17 APE8-rot-na 34.3 APE67-dihe-in -66.28, -28.18 -71.13, -18.84 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 9.4737 None None None XRAY 2.65 0.21 0.252 B 286.0 259.0 19 29 16 13 [[267, 518]] 1.0 4dgg Gallus gallus TYR_SRC_CHICK TYR 3.4e-94 320.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_CHICK 4DGGA P00523 256 533 533.0 I76:601 Type1.5_Front Inactive DFGin 7.1822 16.0519 BLBminus -138.93, 160.43 60.89, 77.08 -83.17, 130.88 289.59, 69.05 -67.2, 999.0 out-none out 12.5009 Saltbr-none 999.0 HRD-in -77.19, -53.85 87.04, -25.32 none-none-out SNCnno none-out ActLoopNT-none 999.0 ActLoopCT-out TYR APEdihe_nniai APEdist_aaao APE10-dihe-none 999.0, 999.0 APE9-dihe-none 999.0, 148.96 APE8-dihe-in -89.03, 71.14 APE8-rot-na 37.27 APE67-dihe-in -65.17, -28.22 -72.82, -18.07 APE12-dist-na 999.0 APE11-dist-na 999.0 APE10-dist-na 999.0 APE9-dist-out 9.8555 None None None XRAY 2.65 0.21 0.252 A 286.0 261.0 17 29 12 17 [[267, 518]] 1.0 4dgg Gallus gallus TYR_SRC_CHICK TYR 3.4e-94 320.9 1.0 260.0 260.0 403 404 405 407 409 295 310 314 383 385 384 386.0 444 432 427 426 425 424 423 422 421 339 Proto-oncogene tyrosine-protein kinase Src
CAMK CDPK1 Q9BJF5_TOXGO 3V51A Q9BJF5 43 507 507.0 I76:701 Type1.5_Back Inactive None 11.621 17.4912 None -103.86, 156.43 80.51, 11.08 -55.27, 132.65 255.66, 102.13 88.39, -19.01 out-out out 14.2465 Saltbr-out 15.4138 HRD-in -87.55, -56.73 77.91, -30.08 out-out-out SNCooo out-out ActLoopNT-out 5.6018 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iooo APE10-dihe-na -53.66, 131.19 APE9-dihe-na 97.99, -20.38 APE8-dihe-out -74.28, -35.69 APE8-rot-out 57.07 APE67-dihe-in -66.67, -30.42 -63.26, -28.58 APE12-dist-in 13.7102 APE11-dist-out 15.908 APE10-dist-out 18.6445 APE9-dist-out 11.5911 None None None XRAY 1.95 0.199 0.234 A 484.0 459.0 0 27 27 0 [[51, 308]] 1.0 3v51 Toxoplasma gondii CAMK_CDPK1_TOXGO CAMK 4.6e-90 307.7 1.0 256.0 256.0 194 195 196 198 200 80 99 103 171 173 172 174.0 232 221 216 215 214 213 212 211 210 129 non-specific serine/threonine protein kinase