Ligand: T3E

Total number of chains: 3
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 4BCKA

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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
CMGC CDK2 CDK2_HUMAN 4BCKA 2.052 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii T3E Type1 1 - 297 0 TPO160 None Cyclin-dependent kinase 2
CMGC CDK2 CDK2_HUMAN 4BCKC 2.052 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii T3E Type1 1 - 294 0 TPO160 None Cyclin-dependent kinase 2
CMGC CDK9 CDK9_HUMAN 4BCIA 3.1 Inactive DFGin‑BLAminus in-out in-in nonTYR APEdihe_aaiii APEdist_iiii T3E Type1 5 - 326 0 TPO186 None Cyclin-dependent kinase 9

Ligand: T3E

Total number of chains: 3
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 4BCKA

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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
CMGC CDK2 CDK2_HUMAN 4BCKA 2.052 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii T3E Type1 1 - 297 0 TPO160 None Cyclin-dependent kinase 2 Homo sapiens
CMGC CDK2 CDK2_HUMAN 4BCKC 2.052 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii T3E Type1 1 - 294 0 TPO160 None Cyclin-dependent kinase 2 Homo sapiens
CMGC CDK9 CDK9_HUMAN 4BCIA 3.1 Inactive DFGin‑BLAminus in-out in-in nonTYR APEdihe_aaiii APEdist_iiii T3E Type1 5 - 326 0 TPO186 None Cyclin-dependent kinase 9 Homo sapiens

Ligand: T3E

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