Crystal structure of murine norovirus RNA-dependent RNA polymerase bound to NF023. Determined by X-ray diffraction at 2.6 Å resolution. Released 2 May 2012.
Explore 3UPF in 3D Show helices and sheets RCSB PDB PDBe
3UPF contains 81 α-helices and 78 β-strands across 3 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.
| Element | Residues | Length | Sheet |
|---|---|---|---|
| β-strand | 8-9 | 2 | 1 |
| β-strand | 12-13 | 2 | 1 |
| β-strand | 14-17 | 4 | 2 |
| α-helix | 20-24 | 5 | |
| β-strand | 27-31 | 5 | 3 |
| α-helix | 36-38 | 3 | |
| β-strand | 43-44 | 2 | 4 |
| α-helix | 45-46 | 2 | |
| α-helix | 59-67 | 9 | |
| α-helix | 68-70 | 3 | |
| α-helix | 73-74 | 2 | |
| α-helix | 76-79 | 4 | |
| α-helix | 80-97 | 18 | |
| α-helix | 98-100 | 3 | |
| α-helix | 102-105 | 4 | |
| α-helix | 106-112 | 7 | |
| β-strand | 118 | 1 | 5 |
| β-strand | 126 | 1 | 5 |
| α-helix | 127-130 | 4 | |
| β-strand | 131 | 1 | 6 |
| β-strand | 136 | 1 | 6 |
| α-helix | 138-152 | 15 | |
| β-strand | 160-165 | 6 | 2 |
| β-strand | 169-170 | 2 | 4 |
| α-helix | 172-174 | 3 | |
| β-strand | 183-186 | 4 | 2 |
| α-helix | 189-208 | 20 | |
| β-strand | 215 | 1 | 7 |
| α-helix | 225-232 | 8 | |
| β-strand | 237-239 | 3 | 7 |
| β-strand | 244 | 1 | 8 |
| α-helix | 252-264 | 13 | |
| α-helix | 269-280 | 12 | |
| β-strand | 283-286 | 4 | 2 |
| β-strand | 290-294 | 5 | 2 |
| α-helix | 305-325 | 21 | |
| α-helix | 329-334 | 6 | |
| β-strand | 336-341 | 6 | 7 |
| β-strand | 344-349 | 6 | 7 |
| α-helix | 355-364 | 10 | |
| β-strand | 368 | 1 | 8 |
| β-strand | 382 | 1 | 7 |
| β-strand | 386 | 1 | 9 |
| β-strand | 388 | 1 | 9 |
| β-strand | 389-390 | 2 | 10 |
| β-strand | 393-398 | 6 | 10 |
| β-strand | 401-406 | 6 | 10 |
| α-helix | 408-416 | 9 | |
| β-strand | 417-423 | 7 | 3 |
| β-strand | 429 | 1 | 3 |
| α-helix | 430 | 1 | |
| α-helix | 440-448 | 9 | |
| α-helix | 452-463 | 12 | |
| α-helix | 478-487 | 10 |
| Element | Residues | Length | Sheet |
|---|---|---|---|
| β-strand | 8-9 | 2 | 11 |
| β-strand | 12-13 | 2 | 11 |
| β-strand | 14-17 | 4 | 12 |
| α-helix | 20-24 | 5 | |
| β-strand | 27-31 | 5 | 13 |
| α-helix | 36-38 | 3 | |
| β-strand | 43-44 | 2 | 14 |
| α-helix | 45-46 | 2 | |
| α-helix | 59-67 | 9 | |
| α-helix | 68-70 | 3 | |
| α-helix | 73-74 | 2 | |
| α-helix | 76-79 | 4 | |
| α-helix | 80-97 | 18 | |
| α-helix | 99-100 | 2 | |
| α-helix | 102-105 | 4 | |
| α-helix | 106-112 | 7 | |
| β-strand | 118 | 1 | 15 |
| β-strand | 126 | 1 | 15 |
| α-helix | 127-130 | 4 | |
| β-strand | 131 | 1 | 16 |
| β-strand | 136 | 1 | 16 |
| α-helix | 138-152 | 15 | |
| β-strand | 160-165 | 6 | 12 |
| β-strand | 169-170 | 2 | 14 |
| α-helix | 173-176 | 4 | |
| β-strand | 183-186 | 4 | 12 |
| α-helix | 189-208 | 20 | |
| β-strand | 215 | 1 | 17 |
| α-helix | 221-232 | 12 | |
| β-strand | 237-239 | 3 | 17 |
| α-helix | 246-249 | 4 | |
| α-helix | 252-264 | 13 | |
| α-helix | 269-280 | 12 | |
| β-strand | 283-286 | 4 | 12 |
| β-strand | 290-294 | 5 | 12 |
| α-helix | 305-325 | 21 | |
| α-helix | 329-334 | 6 | |
| β-strand | 336-341 | 6 | 17 |
| β-strand | 344-349 | 6 | 17 |
| α-helix | 355-364 | 10 | |
| α-helix | 378-380 | 3 | |
| β-strand | 382 | 1 | 17 |
| β-strand | 389-390 | 2 | 18 |
| β-strand | 393-398 | 6 | 18 |
| β-strand | 401-406 | 6 | 18 |
| α-helix | 408-416 | 9 | |
| β-strand | 417-423 | 7 | 13 |
| β-strand | 429 | 1 | 13 |
| α-helix | 437-448 | 12 | |
| α-helix | 452-466 | 15 | |
| α-helix | 478-486 | 9 |
| Element | Residues | Length | Sheet |
|---|---|---|---|
| β-strand | 8-9 | 2 | 19 |
| β-strand | 12-13 | 2 | 19 |
| β-strand | 14-17 | 4 | 20 |
| α-helix | 20-24 | 5 | |
| β-strand | 27-31 | 5 | 21 |
| α-helix | 36-38 | 3 | |
| β-strand | 43-44 | 2 | 22 |
| α-helix | 45-46 | 2 | |
| α-helix | 59-67 | 9 | |
| α-helix | 68-71 | 4 | |
| α-helix | 73-74 | 2 | |
| α-helix | 76-78 | 3 | |
| α-helix | 80-95 | 16 | |
| α-helix | 99-100 | 2 | |
| α-helix | 102-105 | 4 | |
| α-helix | 106-112 | 7 | |
| β-strand | 118 | 1 | 23 |
| β-strand | 126 | 1 | 23 |
| α-helix | 127-130 | 4 | |
| β-strand | 131 | 1 | 24 |
| β-strand | 136 | 1 | 24 |
| α-helix | 138-152 | 15 | |
| β-strand | 161-165 | 5 | 20 |
| β-strand | 169-170 | 2 | 22 |
| α-helix | 173-176 | 4 | |
| β-strand | 183-186 | 4 | 20 |
| α-helix | 189-207 | 19 | |
| β-strand | 215 | 1 | 25 |
| α-helix | 221-232 | 12 | |
| β-strand | 237-239 | 3 | 25 |
| β-strand | 243 | 1 | 26 |
| α-helix | 247-249 | 3 | |
| α-helix | 252-264 | 13 | |
| α-helix | 269-280 | 12 | |
| β-strand | 283-286 | 4 | 20 |
| β-strand | 290-294 | 5 | 20 |
| α-helix | 306-325 | 20 | |
| α-helix | 329-334 | 6 | |
| β-strand | 336-341 | 6 | 25 |
| β-strand | 344-349 | 6 | 25 |
| α-helix | 355-364 | 10 | |
| β-strand | 369 | 1 | 26 |
| α-helix | 378-380 | 3 | |
| β-strand | 382 | 1 | 25 |
| β-strand | 389-390 | 2 | 27 |
| β-strand | 393-398 | 6 | 27 |
| β-strand | 401-406 | 6 | 27 |
| α-helix | 408-416 | 9 | |
| β-strand | 417-423 | 7 | 21 |
| β-strand | 429 | 1 | 21 |
| α-helix | 430 | 1 | |
| α-helix | 437-448 | 12 | |
| α-helix | 452-464 | 13 | |
| α-helix | 478-486 | 9 |
| Molecule | Chains | Type | Length | Organism | UniProt |
|---|---|---|---|---|---|
| RNA-dependent RNA polymerase | A, B, C | protein | 525 | Murine norovirus 1 | Q80J95 (AlphaFold model) |
>3UPF_1 RNA-dependent RNA polymerase (chains A, B, C) MKALEFQGPPMLPRPSGTYAGLPIADYGDAPPLSTKTMFWRTSPEKLPPGAWEPAYLGSK DERVDGPSLQQVMRDQLKPYSEPRGLLPPQEILDAVCDAIENRLENTLEPQKPWTFKKAC ESLDKNTSSGYPYHKQKSKDWTGSAFIGDLGDQATHANNMYEMGKSMRPIYTAALKDELV KPDKIYGKIKKRLLWGSDLGTMIRAARAFGPFCDALKETCIFNPIRVGMSMNEDGPFIFA RHANFRYHMDADYTRWDSTQQRAILKRAGDIMVRLSPEPDLARVVMDDLLAPSLLDVGDY KIVVEEGLPSGCPCTTQLNSLAHWILTLCAMVEVTRVDPDIVMQESEFSFYGDDEVVSTN LELDMVKYTMALRRYGLLPTRADKEEGPLERRQTLQGISFLRRAIVGDQFGWYGRLDRAS IDRQLLWTKGPNHQNPFETLPGHAQRPSQLMALLGEAAMHGEKYYRTVASRVSKEAAQSG IEMVVPRHRSVLRWVRFGTMDAETPQERSAVFVNEDELEHHHHHH
| ID | Name | Formula | Copies |
|---|---|---|---|
| 0BU | 8-({3-[({3-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl}carbamoyl)amino]ben… | C35 H26 N4 O21 S6 | 3 |
Water and common crystallization additives (SO4) are not listed.
Structure-Based Inhibition of Norovirus RNA-Dependent RNA Polymerases. Mastrangelo, E., Pezzullo, M., Tarantino, D. et al. J Mol Biol (2012) 419:198-210. DOI 10.1016/j.jmb.2012.03.008 · PubMed
Other PDB entries of the same protein (UniProt Q80J95 (AlphaFold model), which also has an AlphaFold model), best resolution first:
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