Ligand: IXM

Total number of chains: 6
Active chains: 6
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 6 100.0% 9HULA
All chains - renumbered by
Uniprot PDB Alignment
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Family Gene UniprotID PDB Resolution Activity_label Spatial_Dihedral_labels ChelixSaltbr_label ActLoopNT-ActLoopCT APEtype APEdihe_label APEdist_label Ligand Ligand_type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein
CMGC CDK5 CDK5_HUMAN 1UNHA 2.35 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 2 - 288 0 None D144N Cyclin-dependent kinase 5
CMGC CDK5 CDK5_HUMAN 1UNHB 2.35 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 2 - 288 0 None D144N Cyclin-dependent kinase 5
CMGC GSK3B GSK3B_HUMAN 9HULA 2.9 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii A1IXM Type1 25 - 385 0 None None Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 9HULB 2.9 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii A1IXM Type1 26 - 383 0 None None Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 1Q41A 2.1 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 35 - 386 0 None None Glycogen synthase kinase-3 beta
CMGC GSK3B GSK3B_HUMAN 1Q41B 2.1 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 35 - 383 0 None None Glycogen synthase kinase-3 beta

Ligand: IXM

Total number of chains: 7
Active chains: 6
Total number of genes: 3
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 7 100.0% 9HULA
All chains - renumbered by
Uniprot PDB Alignment
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Family Gene UniprotID PDB Resolution Activity_label Spatial_Dihedral_labels ChelixSaltbr_label ActLoopNT-ActLoopCT APEtype APEdihe_label APEdist_label Ligand Ligand_type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
CMGC CDK Q5CRJ8_CRYPI 2QKRA 2.6 Inactive DFGin‑BLAminus in-out in-out nonTYR APEdihe_aaioi APEdist_nnoo IXM Type1 1 - 292 0 None None Cyclin-dependent kinase 2 homolog Cryptosporidium parvum
CMGC CDK5 CDK5_HUMAN 1UNHA 2.35 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 2 - 288 0 None D144N Cyclin-dependent kinase 5 Homo sapiens
CMGC CDK5 CDK5_HUMAN 1UNHB 2.35 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 2 - 288 0 None D144N Cyclin-dependent kinase 5 Homo sapiens
CMGC GSK3B GSK3B_HUMAN 9HULA 2.9 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii A1IXM Type1 25 - 385 0 None None Glycogen synthase kinase-3 beta Homo sapiens
CMGC GSK3B GSK3B_HUMAN 9HULB 2.9 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii A1IXM Type1 26 - 383 0 None None Glycogen synthase kinase-3 beta Homo sapiens
CMGC GSK3B GSK3B_HUMAN 1Q41A 2.1 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 35 - 386 0 None None Glycogen synthase kinase-3 beta Homo sapiens
CMGC GSK3B GSK3B_HUMAN 1Q41B 2.1 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IXM Type1 35 - 383 0 None None Glycogen synthase kinase-3 beta Homo sapiens

Ligand: IXM

Total number of chains: 1
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 100.0% 2QKRA
All chains - renumbered by
Uniprot PDB Alignment
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Family Gene UniprotID PDB Resolution Activity_label Spatial_Dihedral_labels ChelixSaltbr_label ActLoopNT-ActLoopCT APEtype APEdihe_label APEdist_label Ligand Ligand_type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
CMGC CDK Q5CRJ8_CRYPI 2QKRA 2.6 Inactive DFGin‑BLAminus in-out in-out nonTYR APEdihe_aaioi APEdist_nnoo IXM Type1 1 - 292 0 None None Cyclin-dependent kinase 2 homolog Cryptosporidium parvum