Ligand: G95

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% 3E87A
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 AKT2 AKT2_HUMAN 3E87A P31751 146 480 481.0 G95:1 Type1 Active DFGin 6.3556 13.3413 BLAminus -126.04, 163.87 68.85, 90.68 -105.7, 33.53 302.5, 89.72 -71.05, -31.02 in-in in 9.1955 Saltbr-in 2.6726 HRD-in -74.63, -46.2 65.87, 9.52 in-in-in SNCiii in-in ActLoopNT-in 2.9656 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -157.82, 164.29 APE9-dihe-na 138.82, -139.79 APE8-dihe-in -129.72, 130.9 APE8-rot-in 295.88 APE67-dihe-in -69.5, -20.74 -43.13, -48.06 APE12-dist-in 8.2584 APE11-dist-in 11.703 APE10-dist-in 6.1143 APE9-dist-in 3.6694 S474D TPO309,TPO451 TPO309,TPO451 XRAY 2.3 0.226 0.246 A 335.0 323.0 0 28 28 0 [[152, 409]] 1.0 3e87 AGC_AKT2_HUMAN AGC 1.7e-99 338.1 1.0 260.0 260.0 292 293 294 296 298 181 200 204 272 274 273 275.0 332 320 315 314 313 312 311 310 309 230 RAC-beta serine/threonine-protein kinase
AGC AKT2 AKT2_HUMAN 3E87B P31751 146 480 481.0 G95:1 Type1 Active DFGin 6.3633 13.3278 BLAminus -125.6, 164.26 67.65, 91.39 -106.11, 33.4 302.92, 90.11 -70.63, -30.74 in-in in 9.2067 Saltbr-in 2.6574 HRD-in -73.89, -47.28 67.09, 8.94 in-in-in SNCiii in-in ActLoopNT-in 2.96 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -157.82, 163.8 APE9-dihe-na 138.15, -140.19 APE8-dihe-in -128.95, 131.51 APE8-rot-in 293.83 APE67-dihe-in -69.92, -20.28 -43.71, -47.61 APE12-dist-in 8.2657 APE11-dist-in 11.7056 APE10-dist-in 6.1146 APE9-dist-in 3.6639 S474D TPO309,TPO451 TPO309,TPO451 XRAY 2.3 0.226 0.246 B 335.0 323.0 0 28 28 0 [[152, 409]] 1.0 3e87 AGC_AKT2_HUMAN AGC 1.7e-99 338.1 1.0 260.0 260.0 292 293 294 296 298 181 200 204 272 274 273 275.0 332 320 315 314 313 312 311 310 309 230 RAC-beta serine/threonine-protein kinase

Ligand: G95

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% 3E87A
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 AKT2 AKT2_HUMAN 3E87A P31751 146 480 481.0 G95:1 Type1 Active DFGin 6.3556 13.3413 BLAminus -126.04, 163.87 68.85, 90.68 -105.7, 33.53 302.5, 89.72 -71.05, -31.02 in-in in 9.1955 Saltbr-in 2.6726 HRD-in -74.63, -46.2 65.87, 9.52 in-in-in SNCiii in-in ActLoopNT-in 2.9656 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -157.82, 164.29 APE9-dihe-na 138.82, -139.79 APE8-dihe-in -129.72, 130.9 APE8-rot-in 295.88 APE67-dihe-in -69.5, -20.74 -43.13, -48.06 APE12-dist-in 8.2584 APE11-dist-in 11.703 APE10-dist-in 6.1143 APE9-dist-in 3.6694 S474D TPO309,TPO451 TPO309,TPO451 XRAY 2.3 0.226 0.246 A 335.0 323.0 0 28 28 0 [[152, 409]] 1.0 3e87 Homo sapiens AGC_AKT2_HUMAN AGC 1.7e-99 338.1 1.0 260.0 260.0 292 293 294 296 298 181 200 204 272 274 273 275.0 332 320 315 314 313 312 311 310 309 230 RAC-beta serine/threonine-protein kinase
AGC AKT2 AKT2_HUMAN 3E87B P31751 146 480 481.0 G95:1 Type1 Active DFGin 6.3633 13.3278 BLAminus -125.6, 164.26 67.65, 91.39 -106.11, 33.4 302.92, 90.11 -70.63, -30.74 in-in in 9.2067 Saltbr-in 2.6574 HRD-in -73.89, -47.28 67.09, 8.94 in-in-in SNCiii in-in ActLoopNT-in 2.96 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -157.82, 163.8 APE9-dihe-na 138.15, -140.19 APE8-dihe-in -128.95, 131.51 APE8-rot-in 293.83 APE67-dihe-in -69.92, -20.28 -43.71, -47.61 APE12-dist-in 8.2657 APE11-dist-in 11.7056 APE10-dist-in 6.1146 APE9-dist-in 3.6639 S474D TPO309,TPO451 TPO309,TPO451 XRAY 2.3 0.226 0.246 B 335.0 323.0 0 28 28 0 [[152, 409]] 1.0 3e87 Homo sapiens AGC_AKT2_HUMAN AGC 1.7e-99 338.1 1.0 260.0 260.0 292 293 294 296 298 181 200 204 272 274 273 275.0 332 320 315 314 313 312 311 310 309 230 RAC-beta serine/threonine-protein kinase

Ligand: G95

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