Ligand: UCN

Total number of chains: 4
Active chains: 2
Total number of genes: 3
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 1PKDA
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
AGC PDPK1 PDPK1_HUMAN 1OKZA O15530 73 359 556.0 UCN:1370 Type1 Inactive DFGin 6.5441 14.1675 BLAminus -141.57, -164.78 67.55, 76.85 -103.78, 11.05 287.85, 85.4 -63.67, 2.06 in-in in 8.7271 Saltbr-in 2.7175 HRD-in -70.44, -54.0 75.32, 3.69 in-in-out SNCiio in-out ActLoopNT-in 2.9208 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -147.16, 105.01 APE9-dihe-na -62.12, -140.62 APE8-dihe-in -78.85, 125.76 APE8-rot-in 304.75 APE67-dihe-in -63.07, -21.46 -38.09, -52.99 APE12-dist-in 9.5567 APE11-dist-out 6.099 APE10-dist-out 10.4075 APE9-dist-in 4.1656 None SEP241 SEP241 XRAY 2.51 0.19 0.257 A 310.0 278.0 9 30 21 9 [[82, 342]] 1.0 1okz AGC_PDPK1_HUMAN AGC 1.3e-84 289.3 1.0 260.0 260.0 222 223 224 226 228 111 130 134 202 204 203 205.0 264 252 247 246 245 244 243 242 241 160 3-phosphoinositide-dependent protein kinase 1
CAMK CHEK1 CHK1_HUMAN 1NVQA O14757 3 273 476.0 UCN:400 Type1 Active DFGin 7.1027 14.3956 BLAminus -125.86, 163.9 66.03, 91.68 -101.2, 28.08 286.61, 74.15 -67.93, -18.15 in-in in 8.5165 Saltbr-in 2.8732 HRD-in -72.89, -40.79 69.72, -3.58 in-in-in SNCiii in-in ActLoopNT-in 2.9631 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.67, 158.23 APE9-dihe-na 121.41, -157.73 APE8-dihe-in -131.99, 117.0 APE8-rot-in 305.5 APE67-dihe-in -60.55, -25.67 -32.5, -52.91 APE12-dist-in 9.2975 APE11-dist-in 11.5135 APE10-dist-in 5.7465 APE9-dist-in 3.3787 None None None XRAY 2.0 0.206 0.234 A 289.0 264.0 7 30 30 0 [[9, 265]] 1.0 1nvq CAMK_CHEK1_HUMAN CAMK 2.6e-71 245.9 2.0 256.0 255.0 147 148 149 151 153 38 55 59 127 129 128 130.0 190 177 172 171 170 169 168 167 166 85 Serine/threonine-protein kinase Chk1
CMGC CDK2 CDK2_HUMAN 1PKDA P24941 1 296 298.0 UCN:60410 Type1 Inactive DFGin 6.5754 15.3869 BLAminus -133.85, 171.83 54.3, 84.1 -93.29, 24.7 280.02, 73.48 -58.68, -37.61 in-out in 8.8019 Saltbr-out 3.6599 HRD-in -78.55, -55.12 71.6, 20.95 out-in-in SNCoii in-in ActLoopNT-in 3.0331 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -141.48, 136.15 APE9-dihe-na 78.94, 132.36 APE8-dihe-in -52.7, 137.01 APE8-rot-in 296.12 APE67-dihe-in -63.8, -19.34 -42.25, -50.85 APE12-dist-in 13.145 APE11-dist-in 10.2175 APE10-dist-in 7.6467 APE9-dist-in 3.3799 None TPO160 TPO160 XRAY 2.3 0.218 0.268 A 297.0 296.0 0 28 28 0 [[4, 286]] 1.0 1pkd CMGC_CDK2_HUMAN CMGC 6.3e-90 307.9 1.0 301.0 301.0 144 145 146 148 150 33 51 55 124 126 125 127.0 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2
CMGC CDK2 CDK2_HUMAN 1PKDC P24941 1 296 298.0 UCN:60411 Type1 Active DFGin 6.4625 15.3197 BLAminus -135.87, 172.38 57.28, 84.68 -94.13, 24.13 279.18, 73.79 -65.7, -30.17 in-in in 8.6325 Saltbr-in 3.4814 HRD-in -72.06, -56.98 67.33, 21.98 in-in-in SNCiii in-in ActLoopNT-in 2.8349 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -142.36, 142.06 APE9-dihe-na 67.64, 128.7 APE8-dihe-in -51.48, 131.97 APE8-rot-in 292.97 APE67-dihe-in -55.98, -21.1 -45.12, -49.62 APE12-dist-in 12.786 APE11-dist-in 9.6944 APE10-dist-in 7.5104 APE9-dist-in 3.479 None TPO160 TPO160 XRAY 2.3 0.218 0.268 C 297.0 296.0 0 28 28 0 [[4, 286]] 1.0 1pkd CMGC_CDK2_HUMAN CMGC 6.3e-90 307.9 1.0 301.0 301.0 144 145 146 148 150 33 51 55 124 126 125 127.0 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2

Ligand: UCN

Total number of chains: 4
Active chains: 2
Total number of genes: 3
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 1PKDA
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
AGC PDPK1 PDPK1_HUMAN 1OKZA O15530 73 359 556.0 UCN:1370 Type1 Inactive DFGin 6.5441 14.1675 BLAminus -141.57, -164.78 67.55, 76.85 -103.78, 11.05 287.85, 85.4 -63.67, 2.06 in-in in 8.7271 Saltbr-in 2.7175 HRD-in -70.44, -54.0 75.32, 3.69 in-in-out SNCiio in-out ActLoopNT-in 2.9208 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -147.16, 105.01 APE9-dihe-na -62.12, -140.62 APE8-dihe-in -78.85, 125.76 APE8-rot-in 304.75 APE67-dihe-in -63.07, -21.46 -38.09, -52.99 APE12-dist-in 9.5567 APE11-dist-out 6.099 APE10-dist-out 10.4075 APE9-dist-in 4.1656 None SEP241 SEP241 XRAY 2.51 0.19 0.257 A 310.0 278.0 9 30 21 9 [[82, 342]] 1.0 1okz Homo sapiens AGC_PDPK1_HUMAN AGC 1.3e-84 289.3 1.0 260.0 260.0 222 223 224 226 228 111 130 134 202 204 203 205.0 264 252 247 246 245 244 243 242 241 160 3-phosphoinositide-dependent protein kinase 1
CAMK CHEK1 CHK1_HUMAN 1NVQA O14757 3 273 476.0 UCN:400 Type1 Active DFGin 7.1027 14.3956 BLAminus -125.86, 163.9 66.03, 91.68 -101.2, 28.08 286.61, 74.15 -67.93, -18.15 in-in in 8.5165 Saltbr-in 2.8732 HRD-in -72.89, -40.79 69.72, -3.58 in-in-in SNCiii in-in ActLoopNT-in 2.9631 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.67, 158.23 APE9-dihe-na 121.41, -157.73 APE8-dihe-in -131.99, 117.0 APE8-rot-in 305.5 APE67-dihe-in -60.55, -25.67 -32.5, -52.91 APE12-dist-in 9.2975 APE11-dist-in 11.5135 APE10-dist-in 5.7465 APE9-dist-in 3.3787 None None None XRAY 2.0 0.206 0.234 A 289.0 264.0 7 30 30 0 [[9, 265]] 1.0 1nvq Homo sapiens CAMK_CHEK1_HUMAN CAMK 2.6e-71 245.9 2.0 256.0 255.0 147 148 149 151 153 38 55 59 127 129 128 130.0 190 177 172 171 170 169 168 167 166 85 Serine/threonine-protein kinase Chk1
CMGC CDK2 CDK2_HUMAN 1PKDA P24941 1 296 298.0 UCN:60410 Type1 Inactive DFGin 6.5754 15.3869 BLAminus -133.85, 171.83 54.3, 84.1 -93.29, 24.7 280.02, 73.48 -58.68, -37.61 in-out in 8.8019 Saltbr-out 3.6599 HRD-in -78.55, -55.12 71.6, 20.95 out-in-in SNCoii in-in ActLoopNT-in 3.0331 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -141.48, 136.15 APE9-dihe-na 78.94, 132.36 APE8-dihe-in -52.7, 137.01 APE8-rot-in 296.12 APE67-dihe-in -63.8, -19.34 -42.25, -50.85 APE12-dist-in 13.145 APE11-dist-in 10.2175 APE10-dist-in 7.6467 APE9-dist-in 3.3799 None TPO160 TPO160 XRAY 2.3 0.218 0.268 A 297.0 296.0 0 28 28 0 [[4, 286]] 1.0 1pkd Homo sapiens CMGC_CDK2_HUMAN CMGC 6.3e-90 307.9 1.0 301.0 301.0 144 145 146 148 150 33 51 55 124 126 125 127.0 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2
CMGC CDK2 CDK2_HUMAN 1PKDC P24941 1 296 298.0 UCN:60411 Type1 Active DFGin 6.4625 15.3197 BLAminus -135.87, 172.38 57.28, 84.68 -94.13, 24.13 279.18, 73.79 -65.7, -30.17 in-in in 8.6325 Saltbr-in 3.4814 HRD-in -72.06, -56.98 67.33, 21.98 in-in-in SNCiii in-in ActLoopNT-in 2.8349 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -142.36, 142.06 APE9-dihe-na 67.64, 128.7 APE8-dihe-in -51.48, 131.97 APE8-rot-in 292.97 APE67-dihe-in -55.98, -21.1 -45.12, -49.62 APE12-dist-in 12.786 APE11-dist-in 9.6944 APE10-dist-in 7.5104 APE9-dist-in 3.479 None TPO160 TPO160 XRAY 2.3 0.218 0.268 C 297.0 296.0 0 28 28 0 [[4, 286]] 1.0 1pkd Homo sapiens CMGC_CDK2_HUMAN CMGC 6.3e-90 307.9 1.0 301.0 301.0 144 145 146 148 150 33 51 55 124 126 125 127.0 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2

Ligand: UCN

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