Ligand: A1BV8

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 9N4UA
DFGin BLAplus 1 50.0% 9N4UB

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein
STE PAK1 PAK1_HUMAN 9N4UA 1.77 Inactive DFGin‑BLAminus out-out in-in nonTYR APEdihe_aaiii APEdist_iiii A1BV8 Type1.5_Back 249 - 545 0 None None Serine/threonine-protein kinase PAK 1
STE PAK1 PAK1_HUMAN 9N4UB 1.77 Inactive DFGin‑BLAplus out-out none-out nonTYR APEdihe_aaiio APEdist_nnno A1BV8 Type1 255 - 542 0 None None Serine/threonine-protein kinase PAK 1

Ligand: A1BV8

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 9N4UA
DFGin BLAplus 1 50.0% 9N4UB

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
STE PAK1 PAK1_HUMAN 9N4UA 1.77 Inactive DFGin‑BLAminus out-out in-in nonTYR APEdihe_aaiii APEdist_iiii A1BV8 Type1.5_Back 249 - 545 0 None None Serine/threonine-protein kinase PAK 1 Homo sapiens
STE PAK1 PAK1_HUMAN 9N4UB 1.77 Inactive DFGin‑BLAplus out-out none-out nonTYR APEdihe_aaiio APEdist_nnno A1BV8 Type1 255 - 542 0 None None Serine/threonine-protein kinase PAK 1 Homo sapiens

Ligand: A1BV8

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism