Index | Ligand Name | Structure | PDB code | ligand desolvation |
1 | 3nq | Human Cytochrome P450 17A1 in complex with inhibitor: abiraterone C6 oxime | 6cir | 98.85 |
2 | plo | Human steroidogenic cytochrome P450 17A1 mutant A105L with substrate pregnenolone | 4nkw | 98.78 |
3 | 8qd | Human steroidogenic cytochrome P450 17A1 with 3alphaOH-5alpha-abiraterone analog | 5uys | 98.71 |
4 | 3qz | Human steroidogenic cytochrome P450 17A1 mutant A105L with substrate 17alpha-hydroxyprogesterone | 4nky | 98.71 |
5 | aer | Human steroidogenic cytochrome P450 17A1 mutant A105L with inhibitor abiraterone | 4nkv | 98.57 |
6 | 3nx | Human Cytochrome P450 17A1 in complex with inhibitor: abiraterone C6 amide | 6chi | 98.46 |
7 | str | Human steroidogenic cytochrome P450 17A1 mutant A105L with substrate progesterone | 4nkx | 98.41 |
8 | aer | Human Cytochrome P450 CYP17A1 in complex with Abiraterone | 3ruk | 97.73 |
9 | tok | Human Cytochrome P450 17A1 in complex with TOK-001 | 3swz | 97.58 |
10 | 3nr | Human Cytochrome P450 17A1 in complex with inhibitor: abiraterone C6 nitrile | 6ciz | 97.41 |
11 | 6d7 | Human cytochrome P450 17A1 bound to inhibitors (R)- and (S)- orteronel | 5irq | 96.29 |