Ligand: BK3

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: BK3

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 1 50.0% 3MWUA
None None 1 50.0% 3N51A
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
CAMK CDPK1 A3FQ16_CRYPI 3MWUA A3FQ16 70 536 538.0 BK3:60561 Type1 Inactive DFGin 6.7604 13.8786 BLBplus -124.97, 174.34 60.43, 62.37 -148.95, 167.29 59.92, 89.61 90.92, -9.38 out-out out 14.1949 Saltbr-out 13.325 HRD-in -70.22, -53.61 86.71, -27.32 out-out-out SNCooo out-out ActLoopNT-out 9.0472 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oooo APE10-dihe-na -77.27, 123.06 APE9-dihe-na 101.65, -0.96 APE8-dihe-out -61.02, -32.36 APE8-rot-out 187.25 APE67-dihe-in -57.16, -27.79 -53.76, -33.46 APE12-dist-out 20.0843 APE11-dist-out 17.1014 APE10-dist-out 22.5718 APE9-dist-out 12.6976 None None None XRAY 1.98 0.196 0.229 A 486.0 443.0 4 27 23 4 [[76, 332]] 1.0 3mwu Cryptosporidium parvum CAMK_CDPK1_CRYPI CAMK 3.4e-90 308.1 1.0 256.0 256.0 218 219 220 222 224 105 123 127 195 197 196 198.0 256 245 240 239 238 237 236 235 234 153 non-specific serine/threonine protein kinase
CAMK CDPK1 Q9BJF5_TOXGO 3N51A Q9BJF5 45 507 507.0 BK3:701 Type1 Inactive None 11.5603 18.0695 None -105.99, 154.96 79.96, 9.08 -52.13, 134.61 250.93, 100.91 81.27, -14.94 out-out out 14.7774 Saltbr-out 13.4974 HRD-in -90.11, -58.17 81.56, -35.3 out-out-out SNCooo out-out ActLoopNT-out 5.7082 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iooo APE10-dihe-na -70.15, 129.19 APE9-dihe-na 82.06, -11.3 APE8-dihe-out -58.67, -35.31 APE8-rot-out 59.42 APE67-dihe-in -65.4, -32.25 -62.49, -30.11 APE12-dist-in 13.9612 APE11-dist-out 14.9413 APE10-dist-out 18.6508 APE9-dist-out 11.6772 None None None XRAY 2.1 0.196 0.242 A 484.0 448.0 0 27 27 0 [[51, 308]] 1.0 3n51 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: BK3

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 1 50.0% 3MWUA
None None 1 50.0% 3N51A
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
CAMK CDPK1 A3FQ16_CRYPI 3MWUA A3FQ16 70 536 538.0 BK3:60561 Type1 Inactive DFGin 6.7604 13.8786 BLBplus -124.97, 174.34 60.43, 62.37 -148.95, 167.29 59.92, 89.61 90.92, -9.38 out-out out 14.1949 Saltbr-out 13.325 HRD-in -70.22, -53.61 86.71, -27.32 out-out-out SNCooo out-out ActLoopNT-out 9.0472 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_oooo APE10-dihe-na -77.27, 123.06 APE9-dihe-na 101.65, -0.96 APE8-dihe-out -61.02, -32.36 APE8-rot-out 187.25 APE67-dihe-in -57.16, -27.79 -53.76, -33.46 APE12-dist-out 20.0843 APE11-dist-out 17.1014 APE10-dist-out 22.5718 APE9-dist-out 12.6976 None None None XRAY 1.98 0.196 0.229 A 486.0 443.0 4 27 23 4 [[76, 332]] 1.0 3mwu Cryptosporidium parvum CAMK_CDPK1_CRYPI CAMK 3.4e-90 308.1 1.0 256.0 256.0 218 219 220 222 224 105 123 127 195 197 196 198.0 256 245 240 239 238 237 236 235 234 153 non-specific serine/threonine protein kinase
CAMK CDPK1 Q9BJF5_TOXGO 3N51A Q9BJF5 45 507 507.0 BK3:701 Type1 Inactive None 11.5603 18.0695 None -105.99, 154.96 79.96, 9.08 -52.13, 134.61 250.93, 100.91 81.27, -14.94 out-out out 14.7774 Saltbr-out 13.4974 HRD-in -90.11, -58.17 81.56, -35.3 out-out-out SNCooo out-out ActLoopNT-out 5.7082 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iooo APE10-dihe-na -70.15, 129.19 APE9-dihe-na 82.06, -11.3 APE8-dihe-out -58.67, -35.31 APE8-rot-out 59.42 APE67-dihe-in -65.4, -32.25 -62.49, -30.11 APE12-dist-in 13.9612 APE11-dist-out 14.9413 APE10-dist-out 18.6508 APE9-dist-out 11.6772 None None None XRAY 2.1 0.196 0.242 A 484.0 448.0 0 27 27 0 [[51, 308]] 1.0 3n51 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