Ligand: 3DX

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% 4QYHA
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 CHEK1 CHK1_HUMAN 4QYHA O14757 3 273 476.0 3DX:301 Type1 Active DFGin 6.7137 13.8411 BLAminus -127.62, 167.13 70.22, 81.93 -93.79, 22.64 293.4, 81.54 -68.79, -21.86 in-in in 8.4178 Saltbr-in 3.1262 HRD-in -75.71, -43.97 72.44, 2.65 in-in-in SNCiii in-in ActLoopNT-in 2.9372 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -159.3, 173.48 APE9-dihe-na 109.75, -150.14 APE8-dihe-in -135.16, 119.63 APE8-rot-in 304.63 APE67-dihe-in -60.05, -24.72 -49.2, -45.16 APE12-dist-in 9.0299 APE11-dist-in 11.6728 APE10-dist-in 6.1117 APE9-dist-in 3.3983 None None None XRAY 1.9 0.199 0.235 A 298.0 264.0 7 30 30 0 [[9, 265]] 1.0 4qyh CAMK_CHEK1_HUMAN CAMK 2.9e-71 245.7 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
CAMK CHEK1 CHK1_HUMAN 4QYHB O14757 3 273 476.0 3DX:301 Type1 Active DFGin 6.8786 14.0089 BLAminus -124.39, 169.48 67.51, 85.49 -93.96, 24.74 292.25, 85.07 -64.1, -25.79 in-in in 8.5112 Saltbr-in 2.7919 HRD-in -72.54, -45.81 74.0, 2.82 in-in-in SNCiii in-in ActLoopNT-in 2.8776 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -158.18, 171.25 APE9-dihe-na 115.52, -148.64 APE8-dihe-in -137.75, 119.64 APE8-rot-in 296.85 APE67-dihe-in -60.78, -22.11 -45.63, -50.5 APE12-dist-in 9.1253 APE11-dist-in 11.7658 APE10-dist-in 6.1761 APE9-dist-in 3.4579 None None None XRAY 1.9 0.199 0.235 B 298.0 264.0 7 30 30 0 [[9, 265]] 1.0 4qyh CAMK_CHEK1_HUMAN CAMK 2.9e-71 245.7 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

Ligand: 3DX

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% 4QYHA
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 CHEK1 CHK1_HUMAN 4QYHA O14757 3 273 476.0 3DX:301 Type1 Active DFGin 6.7137 13.8411 BLAminus -127.62, 167.13 70.22, 81.93 -93.79, 22.64 293.4, 81.54 -68.79, -21.86 in-in in 8.4178 Saltbr-in 3.1262 HRD-in -75.71, -43.97 72.44, 2.65 in-in-in SNCiii in-in ActLoopNT-in 2.9372 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -159.3, 173.48 APE9-dihe-na 109.75, -150.14 APE8-dihe-in -135.16, 119.63 APE8-rot-in 304.63 APE67-dihe-in -60.05, -24.72 -49.2, -45.16 APE12-dist-in 9.0299 APE11-dist-in 11.6728 APE10-dist-in 6.1117 APE9-dist-in 3.3983 None None None XRAY 1.9 0.199 0.235 A 298.0 264.0 7 30 30 0 [[9, 265]] 1.0 4qyh Homo sapiens CAMK_CHEK1_HUMAN CAMK 2.9e-71 245.7 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
CAMK CHEK1 CHK1_HUMAN 4QYHB O14757 3 273 476.0 3DX:301 Type1 Active DFGin 6.8786 14.0089 BLAminus -124.39, 169.48 67.51, 85.49 -93.96, 24.74 292.25, 85.07 -64.1, -25.79 in-in in 8.5112 Saltbr-in 2.7919 HRD-in -72.54, -45.81 74.0, 2.82 in-in-in SNCiii in-in ActLoopNT-in 2.8776 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -158.18, 171.25 APE9-dihe-na 115.52, -148.64 APE8-dihe-in -137.75, 119.64 APE8-rot-in 296.85 APE67-dihe-in -60.78, -22.11 -45.63, -50.5 APE12-dist-in 9.1253 APE11-dist-in 11.7658 APE10-dist-in 6.1761 APE9-dist-in 3.4579 None None None XRAY 1.9 0.199 0.235 B 298.0 264.0 7 30 30 0 [[9, 265]] 1.0 4qyh Homo sapiens CAMK_CHEK1_HUMAN CAMK 2.9e-71 245.7 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

Ligand: 3DX

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