Ligand: A1H6X

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 9ET4C
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 9ET4A P24941 1 292 298.0 A1H6X:60601,A1H6X:60603 Type1,Allosteric Active DFGin 6.6335 15.549 BLAminus -134.84, 172.65 61.14, 83.32 -99.32, 22.95 280.23, 75.12 -63.71, -31.1 in-in in 8.6926 Saltbr-in 3.1247 HRD-in -81.89, -57.78 79.18, 16.7 in-in-in SNCiii in-in ActLoopNT-in 2.9426 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -78.49, 161.44 APE9-dihe-na 79.45, 129.92 APE8-dihe-in -54.31, 127.59 APE8-rot-in 279.58 APE67-dihe-in -56.0, -21.82 -38.83, -54.37 APE12-dist-in 13.0325 APE11-dist-in 12.2292 APE10-dist-in 7.2594 APE9-dist-in 3.4052 None TPO160 TPO160 XRAY 2.641 0.22 0.222 A 302.0 289.0 3 28 28 0 [[4, 286]] 1.0 9et4 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 9ET4C P24941 1 294 298.0 A1H6X:60501,A1H6X:60502 Type1,Allosteric Active DFGin 6.6493 15.4365 BLAminus -135.93, -174.31 48.97, 78.73 -88.03, 26.85 282.26, 61.74 -61.22, -38.83 in-in in 8.6134 Saltbr-in 2.7804 HRD-in -94.76, -49.17 61.89, 17.84 in-in-in SNCiii in-in ActLoopNT-in 2.9052 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.87, 147.92 APE9-dihe-na 79.68, 125.87 APE8-dihe-in -54.62, 145.03 APE8-rot-in 295.75 APE67-dihe-in -55.12, -26.19 -51.19, -50.76 APE12-dist-in 12.8076 APE11-dist-in 10.2191 APE10-dist-in 6.9552 APE9-dist-in 3.3009 None TPO160 TPO160 XRAY 2.641 0.22 0.222 C 302.0 294.0 0 28 28 0 [[4, 286]] 1.0 9et4 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

Ligand: A1H6X

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 9ET4C
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 9ET4A P24941 1 292 298.0 A1H6X:60601,A1H6X:60603 Type1,Allosteric Active DFGin 6.6335 15.549 BLAminus -134.84, 172.65 61.14, 83.32 -99.32, 22.95 280.23, 75.12 -63.71, -31.1 in-in in 8.6926 Saltbr-in 3.1247 HRD-in -81.89, -57.78 79.18, 16.7 in-in-in SNCiii in-in ActLoopNT-in 2.9426 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -78.49, 161.44 APE9-dihe-na 79.45, 129.92 APE8-dihe-in -54.31, 127.59 APE8-rot-in 279.58 APE67-dihe-in -56.0, -21.82 -38.83, -54.37 APE12-dist-in 13.0325 APE11-dist-in 12.2292 APE10-dist-in 7.2594 APE9-dist-in 3.4052 None TPO160 TPO160 XRAY 2.641 0.22 0.222 A 302.0 289.0 3 28 28 0 [[4, 286]] 1.0 9et4 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 9ET4C P24941 1 294 298.0 A1H6X:60501,A1H6X:60502 Type1,Allosteric Active DFGin 6.6493 15.4365 BLAminus -135.93, -174.31 48.97, 78.73 -88.03, 26.85 282.26, 61.74 -61.22, -38.83 in-in in 8.6134 Saltbr-in 2.7804 HRD-in -94.76, -49.17 61.89, 17.84 in-in-in SNCiii in-in ActLoopNT-in 2.9052 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -137.87, 147.92 APE9-dihe-na 79.68, 125.87 APE8-dihe-in -54.62, 145.03 APE8-rot-in 295.75 APE67-dihe-in -55.12, -26.19 -51.19, -50.76 APE12-dist-in 12.8076 APE11-dist-in 10.2191 APE10-dist-in 6.9552 APE9-dist-in 3.3009 None TPO160 TPO160 XRAY 2.641 0.22 0.222 C 302.0 294.0 0 28 28 0 [[4, 286]] 1.0 9et4 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

Ligand: A1H6X

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