E3Docker 2.0
- An Integrated Platform for E3 Ligase Discovery and Docking
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Kelch-like ECH-associated protein 1
Uniprot accession number:
Q14145
Recommend structure for docking:
6tym_A
Choose Structure:
6tym_A
8ixs_A
8ivr_A
6lrz_A
6v6z_A
6v6z_B
6v6z_C
6v6z_D
6hws_A
8ivg_A
6uf0_A
6uf0_B
4iqk_A
3vng_A
3vnh_A
7q6s_A
5who_A
5wiy_A
4l7d_A
4l7d_B
4l7d_C
7q8r_A
7xm2_X
7q5h_A
5daf_A
6z6a_A
4ifn_X
4l7c_A
4l7c_B
4l7c_C
7xm5_A
4l7b_B
7q96_A
4xmb_A
5whl_A
6typ_A
4n1b_A
4n1b_B
4n1b_C
7q6q_A
6sp1_A
4in4_A
4in4_B
4in4_C
6sp4_A
6sp4_B
6sp4_C
6sp4_D
6sp4_E
6sp4_F
5dad_A
4cxt_A
7xm4_A
7xot_A
7xm3_A
7x4x_A
7x4x_B
7x4x_C
7x4x_D
7x4x_E
7x4x_F
7x4w_A
7x4w_B
7x4w_D
2flu_X
8pkw_B
8pkv_B
8pku_B
8pkx_B
4ifl_X
7k2a_A
5wfv_A
7k2k_B
7k2l_A
6t7z_A
5wg1_A
7k2m_A
7k2e_A
8ejr_B
7k2h_B
6fmq_A
6fmq_B
7k2r_A
7k2c_A
7k2o_A
7k2p_A
7k2s_A
7q6s_B
7k28_B
7k2g_B
3zgc_A
7k29_A
7k2d_B
7k2n_A
8ehv_B
5x54_A
5x54_B
7k2b_B
7k2f_A
7k2q_B
7k2i_B
7k2j_B
6t7v_A
6tg8_AAA
8ejs_B
6fmp_A
6fmp_B
AF(90)
Upload Receptor:
Optional. Upload a PDB receptor if you do not want to use a predefined E3 structure.
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Input Ligand:
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Search ligand database
Library ligand selected: KI-696 (LIG001931)
LIG001931.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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