Ligand: SQZ

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% 5X8IA
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 CLK1 CLK1_HUMAN 5X8IA P49759 154 481 484.0 SQZ:501 Type1 Active DFGin 7.3534 13.9989 BLAminus -122.66, 172.48 71.45, 69.85 -89.46, 19.16 303.2, 86.95 -71.61, -17.76 in-in in 8.3789 Saltbr-in 2.5421 HRD-in -68.32, -52.49 79.94, -11.57 in-in-in SNCiii in-in ActLoopNT-in 2.8658 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.32, 168.72 APE9-dihe-na 74.05, 158.08 APE8-dihe-in -81.53, 144.19 APE8-rot-in 300.53 APE67-dihe-in -65.15, -11.28 -51.71, -50.28 APE12-dist-in 13.0833 APE11-dist-in 11.6511 APE10-dist-in 7.533 APE9-dist-in 3.016 R432A None None XRAY 1.902 0.168 0.206 A 346.0 328.0 0 25 25 0 [[161, 477]] 1.0 5x8i CMGC_CLK1_HUMAN CMGC 2.7e-93 318.4 1.0 301.0 301.0 324 325 326 328 330 191 206 210 285 287 286 288.0 361 349 344 343 342 341 340 339 338 242 Dual specificity protein kinase CLK1
CMGC CLK1 CLK1_HUMAN 5X8IB P49759 155 481 484.0 SQZ:501 Type1 Active DFGin 7.3842 13.9802 BLAminus -126.45, 170.69 71.83, 69.37 -88.36, 11.76 302.43, 89.48 -69.31, -18.97 in-in in 8.3824 Saltbr-in 2.41 HRD-in -67.27, -52.41 79.09, -12.7 in-in-in SNCiii in-in ActLoopNT-in 2.8887 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.02, 169.54 APE9-dihe-na 72.76, 157.49 APE8-dihe-in -80.25, 143.44 APE8-rot-in 301.33 APE67-dihe-in -65.52, -10.3 -49.82, -50.77 APE12-dist-in 13.1161 APE11-dist-in 11.6767 APE10-dist-in 7.4994 APE9-dist-in 3.0166 R432A None None XRAY 1.902 0.168 0.206 B 346.0 327.0 0 25 25 0 [[161, 477]] 1.0 5x8i CMGC_CLK1_HUMAN CMGC 2.7e-93 318.4 1.0 301.0 301.0 324 325 326 328 330 191 206 210 285 287 286 288.0 361 349 344 343 342 341 340 339 338 242 Dual specificity protein kinase CLK1

Ligand: SQZ

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% 5X8IA
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 CLK1 CLK1_HUMAN 5X8IA P49759 154 481 484.0 SQZ:501 Type1 Active DFGin 7.3534 13.9989 BLAminus -122.66, 172.48 71.45, 69.85 -89.46, 19.16 303.2, 86.95 -71.61, -17.76 in-in in 8.3789 Saltbr-in 2.5421 HRD-in -68.32, -52.49 79.94, -11.57 in-in-in SNCiii in-in ActLoopNT-in 2.8658 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -131.32, 168.72 APE9-dihe-na 74.05, 158.08 APE8-dihe-in -81.53, 144.19 APE8-rot-in 300.53 APE67-dihe-in -65.15, -11.28 -51.71, -50.28 APE12-dist-in 13.0833 APE11-dist-in 11.6511 APE10-dist-in 7.533 APE9-dist-in 3.016 R432A None None XRAY 1.902 0.168 0.206 A 346.0 328.0 0 25 25 0 [[161, 477]] 1.0 5x8i Homo sapiens CMGC_CLK1_HUMAN CMGC 2.7e-93 318.4 1.0 301.0 301.0 324 325 326 328 330 191 206 210 285 287 286 288.0 361 349 344 343 342 341 340 339 338 242 Dual specificity protein kinase CLK1
CMGC CLK1 CLK1_HUMAN 5X8IB P49759 155 481 484.0 SQZ:501 Type1 Active DFGin 7.3842 13.9802 BLAminus -126.45, 170.69 71.83, 69.37 -88.36, 11.76 302.43, 89.48 -69.31, -18.97 in-in in 8.3824 Saltbr-in 2.41 HRD-in -67.27, -52.41 79.09, -12.7 in-in-in SNCiii in-in ActLoopNT-in 2.8887 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -130.02, 169.54 APE9-dihe-na 72.76, 157.49 APE8-dihe-in -80.25, 143.44 APE8-rot-in 301.33 APE67-dihe-in -65.52, -10.3 -49.82, -50.77 APE12-dist-in 13.1161 APE11-dist-in 11.6767 APE10-dist-in 7.4994 APE9-dist-in 3.0166 R432A None None XRAY 1.902 0.168 0.206 B 346.0 327.0 0 25 25 0 [[161, 477]] 1.0 5x8i Homo sapiens CMGC_CLK1_HUMAN CMGC 2.7e-93 318.4 1.0 301.0 301.0 324 325 326 328 330 191 206 210 285 287 286 288.0 361 349 344 343 342 341 340 339 338 242 Dual specificity protein kinase CLK1

Ligand: SQZ

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