UniProt P16110
Galectin-3 (P16110)
Galectin-3 (UniProt P16110): 4 experimental structures and 1 predicted model on GenesisL1, 4 ligands bound, 3 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- P16110
- Protein
- Galectin-3
- Experimental structures
- 4
- Predicted models
- 1
- Ligands
- 4
- Pockets
- 3 · 1 record with a druggable one
Structures
5 records of P16110 in the MolNFT archive: 4 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 7CXB | Structure of mouse galectin-3 crd in complex with td-139 belonging to P6522 space group. | x-ray diffraction | A | TD2, CL | — |
| 7CXC | Structure of mouse galectin-3 crd point mutant (V160A) in complex with td-139 belonging to P121… | x-ray diffraction | A, B | TD2 | — |
| 7DF6 | Mouse galectin-3 crd in complex with novel tetrahydropyran-based thiodisaccharide mimic inhibitor | x-ray diffraction | A, B | H5O | — |
| 8ILU | Crystal structure of mouse Galectin-3 in complex with small molecule inhibitor | x-ray diffraction | A, B | Q1L | 2 (best 0.51) |
| P16110 | AlphaFold monomer V2.0 prediction for galectin-3 (P16110) | predicted | A | — | 1 (best 0.29) |
Ligands
- TD2 · 3-deoxy-3-[4-(3-fluorophenyl)-1H-1,2,3-triazol-1-yl]-beta-D-galactopyranosyl 3-deoxy-3-[4-(3-fluorophenyl)-1H-1,2,3-triazol-1-yl]-1-thio-beta-D-galactopyranoside · in 2 records
- CL · Chloride ion · in 1 record
- H5O · (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-5-methoxy-6-[(3R,4R, 5S)-4-oxidanyl-5-(4-pyrimidin-5-yl-1,2,3-triazol-1-yl)oxan-3-yl]sulfanyl-4-[4-[3,4,5-tris(fluoranyl) phenyl]-1,2,3-triazol-1-yl]oxan-3-ol · in 1 record
- Q1L · (2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-[2-(2-methyl-1,3-benzothiazol-6-yl)-1,2,4-triazol-3-yl]-4-[4-[3,4,5-tris(fluoranyl)phenyl]-1,2,3-triazol-1-yl]oxane-3,5-diol · in 1 record
Experiment against prediction
- 7CXB chain A against the predicted model P16110: TM-score 1.00, RMSD 0.27 Å
- 7CXC chain A against the predicted model P16110: TM-score 0.99, RMSD 0.36 Å
- 8ILU chain A against the predicted model P16110: TM-score 0.99, RMSD 0.43 Å
- 8ILU chain B against the predicted model P16110: TM-score 0.99, RMSD 0.46 Å
- 7DF6 chain A against the predicted model P16110: TM-score 0.99, RMSD 0.58 Å
Elsewhere
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