Ligand: 01I

Total number of chains: 2
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 3MB6A
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
CAMK PIM1 PIM1_HUMAN 3MA3A P11309 37 305 313.0 01I:313 Type1 Active DFGin 6.0181 14.2367 BLAminus -126.51, 170.48 60.71, 85.71 -91.62, 21.05 288.87, 82.52 -71.65, -14.95 in-in in 8.9174 Saltbr-in 2.6909 HRD-naA -71.5, -42.79 64.42, 10.83 in-in-in SNCiii in-in ActLoopNT-in 2.754 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -123.06, 17.84 APE9-dihe-na -81.84, -163.49 APE8-dihe-in -85.13, 123.05 APE8-rot-in 304.03 APE67-dihe-in -65.07, -11.91 -66.26, -41.53 APE12-dist-in 9.8117 APE11-dist-in 8.4025 APE10-dist-in 5.2207 APE9-dist-in 3.8789 None SEP261 SEP261 XRAY 2.3 0.172 0.233 A 313.0 267.0 2 26 26 0 [[38, 290]] 1.0 3ma3 CAMK_PIM1_HUMAN CAMK 1.5e-64 223.7 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
CMGC CSNK2A1 CSK21_HUMAN 3MB6A P68400 3 331 391.0 01I:332 Type1 Active DFGin 7.4877 16.2666 BLAminus -117.11, 179.59 54.01, 74.57 -84.49, 16.89 297.19, 82.78 -67.45, -20.32 in-in in 9.133 Saltbr-in 2.6588 HRD-in -74.41, -48.59 69.07, 10.21 in-in-in SNCiii in-in ActLoopNT-in 2.9288 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.15, 171.86 APE9-dihe-na 63.04, 162.57 APE8-dihe-in -87.81, 146.63 APE8-rot-in 294.78 APE67-dihe-in -70.05, -13.92 -35.28, -57.11 APE12-dist-in 12.8559 APE11-dist-in 10.5045 APE10-dist-in 6.22 APE9-dist-in 3.2345 None None None XRAY 1.75 0.186 0.229 A 331.0 329.0 0 27 27 0 [[39, 324]] 1.0 3mb6 CMGC_CSNK2A1_HUMAN CMGC 1.3e-69 240.7 1.0 301.0 301.0 174 175 176 178 180 68 81 85 153 155 154 156.0 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha

Ligand: 01I

Total number of chains: 2
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 3MB6A
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 PIM1 PIM1_HUMAN 3MA3A P11309 37 305 313.0 01I:313 Type1 Active DFGin 6.0181 14.2367 BLAminus -126.51, 170.48 60.71, 85.71 -91.62, 21.05 288.87, 82.52 -71.65, -14.95 in-in in 8.9174 Saltbr-in 2.6909 HRD-naA -71.5, -42.79 64.42, 10.83 in-in-in SNCiii in-in ActLoopNT-in 2.754 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -123.06, 17.84 APE9-dihe-na -81.84, -163.49 APE8-dihe-in -85.13, 123.05 APE8-rot-in 304.03 APE67-dihe-in -65.07, -11.91 -66.26, -41.53 APE12-dist-in 9.8117 APE11-dist-in 8.4025 APE10-dist-in 5.2207 APE9-dist-in 3.8789 None SEP261 SEP261 XRAY 2.3 0.172 0.233 A 313.0 267.0 2 26 26 0 [[38, 290]] 1.0 3ma3 Homo sapiens CAMK_PIM1_HUMAN CAMK 1.5e-64 223.7 1.0 256.0 256.0 185 186 187 189 191 67 89 93 164 166 165 167.0 224 211 206 205 204 203 202 201 200 121 Serine/threonine-protein kinase pim-1
CMGC CSNK2A1 CSK21_HUMAN 3MB6A P68400 3 331 391.0 01I:332 Type1 Active DFGin 7.4877 16.2666 BLAminus -117.11, 179.59 54.01, 74.57 -84.49, 16.89 297.19, 82.78 -67.45, -20.32 in-in in 9.133 Saltbr-in 2.6588 HRD-in -74.41, -48.59 69.07, 10.21 in-in-in SNCiii in-in ActLoopNT-in 2.9288 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -136.15, 171.86 APE9-dihe-na 63.04, 162.57 APE8-dihe-in -87.81, 146.63 APE8-rot-in 294.78 APE67-dihe-in -70.05, -13.92 -35.28, -57.11 APE12-dist-in 12.8559 APE11-dist-in 10.5045 APE10-dist-in 6.22 APE9-dist-in 3.2345 None None None XRAY 1.75 0.186 0.229 A 331.0 329.0 0 27 27 0 [[39, 324]] 1.0 3mb6 Homo sapiens CMGC_CSNK2A1_HUMAN CMGC 1.3e-69 240.7 1.0 301.0 301.0 174 175 176 178 180 68 81 85 153 155 154 156.0 214 201 196 195 194 193 192 191 190 114 Casein kinase II subunit alpha

Ligand: 01I

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