Ligand: PYZ

Total number of chains: 3
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 66.7% 9ETBA
None None 1 33.3% 6Q3BA
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 CDK2 CDK2_HUMAN 9ETBA P24941 1 298 298.0 PYZ:60601,PYZ:60602,PYZ:60604,PYZ:60606 Allosteric,Type1,Allosteric,Allosteric Active DFGin 6.6797 15.5696 BLAminus -134.02, 179.89 52.18, 79.05 -90.46, 32.64 275.32, 74.18 -73.39, -29.97 in-in in 8.6166 Saltbr-in 3.4791 HRD-in -84.14, -59.82 72.65, 14.59 in-in-in SNCiii in-in ActLoopNT-in 2.9599 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.68, 145.25 APE9-dihe-na 77.56, 126.12 APE8-dihe-in -50.85, 139.31 APE8-rot-in 306.09 APE67-dihe-in -53.89, -21.84 -51.66, -56.12 APE12-dist-in 12.6787 APE11-dist-in 10.3424 APE10-dist-in 7.1023 APE9-dist-in 3.2048 None TPO160 TPO160 XRAY 2.76 0.213 0.228 A 302.0 298.0 0 28 28 0 [[4, 286]] 1.0 9etb CMGC_CDK2_HUMAN CMGC 6.7e-90 307.8 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 9ETBC P24941 1 296 298.0 PYZ:60501,PYZ:60502,PYZ:60504 Type1,Allosteric,Allosteric Active DFGin 6.7461 15.0192 BLAminus -143.48, -178.64 51.51, 80.46 -98.47, 34.67 277.11, 78.33 -78.48, -28.12 in-in in 8.4058 Saltbr-in 2.9182 HRD-in -77.32, -49.73 69.21, 13.85 in-in-in SNCiii in-in ActLoopNT-in 2.9209 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -141.33, 153.34 APE9-dihe-na 65.12, 133.84 APE8-dihe-in -56.36, 138.43 APE8-rot-in 308.36 APE67-dihe-in -58.62, -30.85 -38.23, -52.66 APE12-dist-in 12.5392 APE11-dist-in 9.6012 APE10-dist-in 6.6171 APE9-dist-in 3.4684 None TPO160 TPO160 XRAY 2.76 0.213 0.228 C 302.0 284.0 12 28 28 0 [[4, 286]] 1.0 9etb CMGC_CDK2_HUMAN CMGC 6.7e-90 307.8 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 6Q3BA P24941 1 298 298.0 PYZ:301,PYZ:302 Type1,Type1 Inactive None 11.6955 18.3692 None -99.21, 147.26 85.4, 20.21 -55.37, 141.31 259.87, 90.07 83.45, -13.95 out-out out 15.7223 Saltbr-out 16.4818 HRD-in -91.88, -62.73 83.2, -16.39 out-out-out SNCooo out-out ActLoopNT-out 5.8624 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoo APE10-dihe-na 999.0, 105.63 APE9-dihe-na -77.44, 137.9 APE8-dihe-in -71.09, 136.23 APE8-rot-out 190.04 APE67-dihe-in -62.88, -22.27 -97.15, -7.75 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 19.8102 APE9-dist-out 10.9264 None None None XRAY 1.11 0.212 0.249 A 306.0 283.0 15 28 20 8 [[4, 286]] 1.0 6q3b CMGC_CDK2_HUMAN CMGC 7e-90 307.7 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: PYZ

Total number of chains: 3
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 66.7% 9ETBA
None None 1 33.3% 6Q3BA
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 CDK2 CDK2_HUMAN 9ETBA P24941 1 298 298.0 PYZ:60601,PYZ:60602,PYZ:60604,PYZ:60606 Allosteric,Type1,Allosteric,Allosteric Active DFGin 6.6797 15.5696 BLAminus -134.02, 179.89 52.18, 79.05 -90.46, 32.64 275.32, 74.18 -73.39, -29.97 in-in in 8.6166 Saltbr-in 3.4791 HRD-in -84.14, -59.82 72.65, 14.59 in-in-in SNCiii in-in ActLoopNT-in 2.9599 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.68, 145.25 APE9-dihe-na 77.56, 126.12 APE8-dihe-in -50.85, 139.31 APE8-rot-in 306.09 APE67-dihe-in -53.89, -21.84 -51.66, -56.12 APE12-dist-in 12.6787 APE11-dist-in 10.3424 APE10-dist-in 7.1023 APE9-dist-in 3.2048 None TPO160 TPO160 XRAY 2.76 0.213 0.228 A 302.0 298.0 0 28 28 0 [[4, 286]] 1.0 9etb Homo sapiens CMGC_CDK2_HUMAN CMGC 6.7e-90 307.8 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 9ETBC P24941 1 296 298.0 PYZ:60501,PYZ:60502,PYZ:60504 Type1,Allosteric,Allosteric Active DFGin 6.7461 15.0192 BLAminus -143.48, -178.64 51.51, 80.46 -98.47, 34.67 277.11, 78.33 -78.48, -28.12 in-in in 8.4058 Saltbr-in 2.9182 HRD-in -77.32, -49.73 69.21, 13.85 in-in-in SNCiii in-in ActLoopNT-in 2.9209 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -141.33, 153.34 APE9-dihe-na 65.12, 133.84 APE8-dihe-in -56.36, 138.43 APE8-rot-in 308.36 APE67-dihe-in -58.62, -30.85 -38.23, -52.66 APE12-dist-in 12.5392 APE11-dist-in 9.6012 APE10-dist-in 6.6171 APE9-dist-in 3.4684 None TPO160 TPO160 XRAY 2.76 0.213 0.228 C 302.0 284.0 12 28 28 0 [[4, 286]] 1.0 9etb Homo sapiens CMGC_CDK2_HUMAN CMGC 6.7e-90 307.8 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 6Q3BA P24941 1 298 298.0 PYZ:301,PYZ:302 Type1,Type1 Inactive None 11.6955 18.3692 None -99.21, 147.26 85.4, 20.21 -55.37, 141.31 259.87, 90.07 83.45, -13.95 out-out out 15.7223 Saltbr-out 16.4818 HRD-in -91.88, -62.73 83.2, -16.39 out-out-out SNCooo out-out ActLoopNT-out 5.8624 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_nnoo APE10-dihe-na 999.0, 105.63 APE9-dihe-na -77.44, 137.9 APE8-dihe-in -71.09, 136.23 APE8-rot-out 190.04 APE67-dihe-in -62.88, -22.27 -97.15, -7.75 APE12-dist-none 999.0 APE11-dist-none 999.0 APE10-dist-out 19.8102 APE9-dist-out 10.9264 None None None XRAY 1.11 0.212 0.249 A 306.0 283.0 15 28 20 8 [[4, 286]] 1.0 6q3b Homo sapiens CMGC_CDK2_HUMAN CMGC 7e-90 307.7 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: PYZ

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