Ligand: 8UV

Total number of chains: 2
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 5UZJB
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 ROCK1 ROCK1_HUMAN 5UZJA Q13464 6 405 1354.0 8UV:60501 Type1 Active DFGin 6.1695 13.1005 BLAminus -139.82, 174.8 51.53, 74.94 -94.18, 44.21 303.79, 97.11 -58.95, -59.6 in-in in 8.6396 Saltbr-in 2.7936 HRD-in -71.22, -41.37 70.75, -24.52 in-in-in SNCiii in-in ActLoopNT-in 3.0257 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -145.33, 135.82 APE9-dihe-na 134.09, -159.86 APE8-dihe-in -104.52, 140.59 APE8-rot-in 298.4 APE67-dihe-in -92.6, -25.3 -52.4, -27.33 APE12-dist-in 11.9065 APE11-dist-in 11.5034 APE10-dist-in 5.9924 APE9-dist-in 4.0306 None None None XRAY 3.3 0.202 0.241 A 415.0 387.0 8 29 29 0 [[76, 338]] 1.0 5uzj AGC_ROCK1_HUMAN AGC 3.5e-94 320.7 1.0 260.0 260.0 215 216 217 219 221 105 124 128 195 197 196 198.0 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 5UZJB Q13464 6 402 1354.0 8UV:60501 Type1 Inactive DFGin 6.1932 13.2335 BLAminus -141.66, 165.11 62.71, 74.36 -91.14, 38.13 303.19, 107.23 -56.15, -61.3 in-in in 8.556 Saltbr-in 2.6692 HRD-in -70.32, -41.49 73.65, -34.67 in-in-out SNCiio in-out ActLoopNT-in 2.9318 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioo APE10-dihe-na -71.09, 138.52 APE9-dihe-na -78.02, -115.28 APE8-dihe-in -91.0, 118.08 APE8-rot-out 62.39 APE67-dihe-in -38.15, -42.63 -62.29, -19.27 APE12-dist-in 8.5087 APE11-dist-in 11.3479 APE10-dist-out 10.7423 APE9-dist-out 9.8493 None None None XRAY 3.3 0.202 0.241 B 415.0 385.0 6 29 29 0 [[76, 338]] 1.0 5uzj AGC_ROCK1_HUMAN AGC 3.5e-94 320.7 1.0 260.0 260.0 215 216 217 219 221 105 124 128 195 197 196 198.0 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1

Ligand: 8UV

Total number of chains: 2
Active chains: 1
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 5UZJB
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 ROCK1 ROCK1_HUMAN 5UZJA Q13464 6 405 1354.0 8UV:60501 Type1 Active DFGin 6.1695 13.1005 BLAminus -139.82, 174.8 51.53, 74.94 -94.18, 44.21 303.79, 97.11 -58.95, -59.6 in-in in 8.6396 Saltbr-in 2.7936 HRD-in -71.22, -41.37 70.75, -24.52 in-in-in SNCiii in-in ActLoopNT-in 3.0257 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -145.33, 135.82 APE9-dihe-na 134.09, -159.86 APE8-dihe-in -104.52, 140.59 APE8-rot-in 298.4 APE67-dihe-in -92.6, -25.3 -52.4, -27.33 APE12-dist-in 11.9065 APE11-dist-in 11.5034 APE10-dist-in 5.9924 APE9-dist-in 4.0306 None None None XRAY 3.3 0.202 0.241 A 415.0 387.0 8 29 29 0 [[76, 338]] 1.0 5uzj Homo sapiens AGC_ROCK1_HUMAN AGC 3.5e-94 320.7 1.0 260.0 260.0 215 216 217 219 221 105 124 128 195 197 196 198.0 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 5UZJB Q13464 6 402 1354.0 8UV:60501 Type1 Inactive DFGin 6.1932 13.2335 BLAminus -141.66, 165.11 62.71, 74.36 -91.14, 38.13 303.19, 107.23 -56.15, -61.3 in-in in 8.556 Saltbr-in 2.6692 HRD-in -70.32, -41.49 73.65, -34.67 in-in-out SNCiio in-out ActLoopNT-in 2.9318 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iioo APE10-dihe-na -71.09, 138.52 APE9-dihe-na -78.02, -115.28 APE8-dihe-in -91.0, 118.08 APE8-rot-out 62.39 APE67-dihe-in -38.15, -42.63 -62.29, -19.27 APE12-dist-in 8.5087 APE11-dist-in 11.3479 APE10-dist-out 10.7423 APE9-dist-out 9.8493 None None None XRAY 3.3 0.202 0.241 B 415.0 385.0 6 29 29 0 [[76, 338]] 1.0 5uzj Homo sapiens AGC_ROCK1_HUMAN AGC 3.5e-94 320.7 1.0 260.0 260.0 215 216 217 219 221 105 124 128 195 197 196 198.0 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1

Ligand: 8UV

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