Index | Ligand Name | Structure | PDB code | ligand desolvation |
1 | 2uu | Crystal Structure of Human MCL-1 Bound to Inhibitor 4-(4-methylnaphthalen-1-yl)-2-{[(4-phenoxyphenyl)sulfonyl]amino}benzoic acid | 4oq5 | 98.87 |
2 | 19h | Discovery of potent Mcl-1 inhibitors using fragment-based methods and structure-based design | 4hw2 | 94.13 |
3 | 2uv | Crystal Structure of Human MCL-1 Bound to Inhibitor 4-hydroxy-4'-propylbiphenyl-3-carboxylic acid | 4oq6 | 89.95 |
4 | 5x2 | Mcl-1 complexed with small molecule inhibitor | 5fdo | 88.67 |
5 | 19h | STRUCTURE OF MBP-MCL1 BOUND TO ligand 2 AT 1.55A | 4wmu | 86.83 |
6 | 19g | Discovery of potent Mcl-1 inhibitors using fragment-based methods and structure-based design | 4hw3 | 86.76 |
7 | cjy | Crystal structure of MCL-1 in complex with a BIM competitive inhibitor | 6b4l | 86.48 |
8 | 4m6 | Mcl-1 complexed with small molecules | 4zbi | 85.28 |
9 | lod | Co-crystal structure of Mcl1 with inhibitor | 6o6f | 84.1 |
10 | loj | Co-crystal structure of Mcl1 with inhibitor | 6o6g | 83.92 |
11 | 4m7 | Mcl-1 complexed with small molecules | 4zbf | 83.59 |
12 | n0s | Crystal structure of Mcl1 with inhibitor 9 | 6oqc | 83.2 |
13 | 5wl | Mcl-1 complexed with small molecule inhibitor | 5fc4 | 82.44 |
14 | n0p | Crystal structure of Mcl1 with inhibitor 7 | 6oqn | 80.08 |
15 | n0m | Crystal structure of Mcl1 with inhibitor 8 | 6oqd | 78.41 |
16 | j1n | Structure of human Mcl-1 in complex with thienopyrimidine inhibitor | 6qgd | 77.66 |
17 | n0j | Co-crystal structure of Mcl1 with inhibitor 10 | 6oqb | 76.56 |
18 | lc3 | Crystal structure of Mcl-1 in complex with compound 4 | 3wix | 76.39 |
19 | 865 | STRUCTURE OF MCL1 BOUND TO BRD inhibitor ligand 1 AT 1.7A | 4wmr | 74.99 |
20 | e4q | MCL1 in complex with an indole acid ligand | 6fs1 | 74.47 |
21 | jl8 | Structure of Mcl-1 in complex with compound 10d | 6qz8 | 73.94 |
22 | jlb | Structure of MBP-Mcl-1 in complex with compound 7a | 6qyk | 73.85 |
23 | jlk | Structure of Mcl-1 in complex with compound 8d | 6qzb | 73.51 |
24 | jle | Structure of Mcl-1 in complex with compound 8b | 6qz6 | 72.82 |
25 | jle | Structure of Mcl-1 in complex with compound 8a | 6qz5 | 72.77 |
26 | jkq | Structure of MBP-Mcl-1 in complex with compound 6a | 6qxj | 72.43 |
27 | jl8 | Structure of MBP-Mcl-1 in complex with compound 10d | 6qyn | 71.26 |
28 | cn7 | Crystal structure of MCL-1 in complex with a BIM competitive inhibitor | 6b4u | 70.93 |
29 | jle | Structure of MBP-Mcl-1 in complex with compound 8b | 6qz7 | 70.59 |
30 | jle | Structure of MBP-Mcl-1 in complex with compound 8a | 6qyl | 70.22 |
31 | 865 | STRUCTURE OF MBP-MCL1 BOUND TO ligand 1 AT 2.35A | 4wmt | 69.07 |
32 | jlh | Structure of MBP-Mcl-1 in complex with compound 18a | 6qyo | 63.36 |
33 | jl5 | Structure of Mcl-1 in complex with compound 13 | 6qyp | 63.28 |