E3Docker 2.0
- An Integrated Platform for E3 Ligase Discovery and Docking
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Lysine-specific demethylase 5A
Uniprot accession number:
P29375
Recommend structure for docking:
6bgy_A
Choose Structure:
6bgy_A
5ivb_A
6dq4_A
5ivy_A
6bh2_A
6dq8_A
5ivc_A
5ivj_A
6bgv_A
6dq6_A
5iw0_A
6bgw_A
6bh5_A
5ivf_A
6bgu_A
5isl_A
6bgz_A
6dqe_A
6dqf_A
6bh3_A
6dq9_A
6dqc_A
5ive_A
6dqb_A
5ivv_A
6dq7_A
6bgx_A
6dq5_A
6dqa_A
6bh1_A
6bh0_A
6dqd_A
6bh4_A
5e6h_A
5iwf_A
5v9p_A
5v9t_A
5v9t_B
5ceh_A
5k4l_A
5k4l_B
AF(71)
Upload Receptor:
Optional. Upload a PDB receptor if you do not want to use a predefined E3 structure.
Select box:
Select predefined box
Define user-specified box
Please select the box
Retry structure loading
Please click to choose the center
Input Ligand:
Upload your molecule
Draw your molecule
Search ligand database
Library ligand selected: Di-N-desethylamiodarone (BDB000431)
BDB000431.sdf
Example input ligand file formats:
[For a single molecule:
mol2
,
sdf
,
smi
]
[For multiple molecules:
mol2
,
sdf
,
smi
]
(The number of small molecules for batch docking shall not exceed 50.)
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Open database
Local MOL2/SDF structures can be selected for docking; E3-ligand records without local files are shown with external 3D download links.
Selected ligand 3D structure
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