Ligand: 1WU

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 4L6QA
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 ROCK2 ROCK2_HUMAN 4L6QA O75116 27 417 1388.0 1WU:501 Type1 Inactive DFGin 6.3025 13.5702 ABAminus -116.27, -49.25 -107.45, 128.66 -126.56, 33.88 304.03, 88.55 -72.5, -17.13 in-in in 8.8823 Saltbr-in 2.672 HRD-in -73.76, -46.68 73.56, -20.06 in-in-out SNCiio in-out ActLoopNT-in 2.9796 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -127.31, 131.57 APE9-dihe-na 145.53, -153.1 APE8-dihe-in -136.66, 121.88 APE8-rot-out 181.69 APE67-dihe-in -54.43, -25.79 -36.79, -58.64 APE12-dist-in 10.6283 APE11-dist-in 11.4732 APE10-dist-in 5.6957 APE9-dist-in 3.9166 None None None XRAY 2.79 0.224 0.281 A 402.0 388.0 0 29 29 0 [[92, 354]] 1.0 4l6q AGC_ROCK2_HUMAN AGC 2.4e-93 318.0 1.0 260.0 260.0 231 232 233 235 237 121 140 144 211 213 212 214.0 276 260 255 254 253 252 251 250 249 170 Rho-associated protein kinase 2
AGC ROCK2 ROCK2_HUMAN 4L6QB O75116 27 417 1388.0 1WU:501 Type1 Inactive DFGin 6.2412 13.4208 ABAminus -107.91, -62.87 -88.93, 144.15 -141.39, 24.98 298.39, 99.37 -69.99, -11.39 in-out in 8.7899 Saltbr-out 4.2152 HRD-in -77.55, -55.12 77.74, -6.89 out-in-in SNCoii in-in ActLoopNT-in 3.1737 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -139.98, 112.76 APE9-dihe-na 161.13, -165.93 APE8-dihe-in -114.84, 120.25 APE8-rot-in 312.46 APE67-dihe-in -62.07, -22.46 -26.22, -64.13 APE12-dist-in 10.2175 APE11-dist-in 11.4445 APE10-dist-in 5.753 APE9-dist-in 3.7448 None None None XRAY 2.79 0.224 0.281 B 402.0 388.0 0 29 29 0 [[92, 354]] 1.0 4l6q AGC_ROCK2_HUMAN AGC 2.4e-93 318.0 1.0 260.0 260.0 231 232 233 235 237 121 140 144 211 213 212 214.0 276 260 255 254 253 252 251 250 249 170 Rho-associated protein kinase 2

Ligand: 1WU

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 2 100.0% 4L6QA
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 ROCK2 ROCK2_HUMAN 4L6QA O75116 27 417 1388.0 1WU:501 Type1 Inactive DFGin 6.3025 13.5702 ABAminus -116.27, -49.25 -107.45, 128.66 -126.56, 33.88 304.03, 88.55 -72.5, -17.13 in-in in 8.8823 Saltbr-in 2.672 HRD-in -73.76, -46.68 73.56, -20.06 in-in-out SNCiio in-out ActLoopNT-in 2.9796 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -127.31, 131.57 APE9-dihe-na 145.53, -153.1 APE8-dihe-in -136.66, 121.88 APE8-rot-out 181.69 APE67-dihe-in -54.43, -25.79 -36.79, -58.64 APE12-dist-in 10.6283 APE11-dist-in 11.4732 APE10-dist-in 5.6957 APE9-dist-in 3.9166 None None None XRAY 2.79 0.224 0.281 A 402.0 388.0 0 29 29 0 [[92, 354]] 1.0 4l6q Homo sapiens AGC_ROCK2_HUMAN AGC 2.4e-93 318.0 1.0 260.0 260.0 231 232 233 235 237 121 140 144 211 213 212 214.0 276 260 255 254 253 252 251 250 249 170 Rho-associated protein kinase 2
AGC ROCK2 ROCK2_HUMAN 4L6QB O75116 27 417 1388.0 1WU:501 Type1 Inactive DFGin 6.2412 13.4208 ABAminus -107.91, -62.87 -88.93, 144.15 -141.39, 24.98 298.39, 99.37 -69.99, -11.39 in-out in 8.7899 Saltbr-out 4.2152 HRD-in -77.55, -55.12 77.74, -6.89 out-in-in SNCoii in-in ActLoopNT-in 3.1737 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -139.98, 112.76 APE9-dihe-na 161.13, -165.93 APE8-dihe-in -114.84, 120.25 APE8-rot-in 312.46 APE67-dihe-in -62.07, -22.46 -26.22, -64.13 APE12-dist-in 10.2175 APE11-dist-in 11.4445 APE10-dist-in 5.753 APE9-dist-in 3.7448 None None None XRAY 2.79 0.224 0.281 B 402.0 388.0 0 29 29 0 [[92, 354]] 1.0 4l6q Homo sapiens AGC_ROCK2_HUMAN AGC 2.4e-93 318.0 1.0 260.0 260.0 231 232 233 235 237 121 140 144 211 213 212 214.0 276 260 255 254 253 252 251 250 249 170 Rho-associated protein kinase 2

Ligand: 1WU

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