Structure of human TRPA1 in complex with antagonist compound 21
Resolution: 3.05 Å
EM Method: Single-particle
Fitted PDBs: 7jup
Q-score: 0.522
Terrett JA, Chen H, Shore DG, Villemure E, Larouche-Gauthier R, Dery M, Beaumier F, Constantineau-Forget L, Grand-Maitre C, Lepissier L, Ciblat S, Sturino C, Chen Y, Hu B, Lu A, Wang Y, Cridland AP, Ward SI, Hackos DH, Reese RM, Shields SD, Chen J, Balestrini A, Riol-Blanco L, Lee WP, Liu J, Suto E, Wu X, Zhang J, Ly JQ, La H, Johnson K, Baumgardner M, Chou KJ, Rohou A, Rouge L, Safina BS, Magnuson S, Volgraf M
J Med Chem (2021) 64 pp. 3843-3869 [ Pubmed: 33749283 DOI: doi:10.1021/acs.jmedchem.0c02023 ]
Structure of human TRPA1 in complex with inhibitor GDC-0334
Resolution: 3.6 Å
EM Method: Single-particle
Fitted PDBs: 6wj5
Q-score: 0.471
Balestrini A, Joseph V, Dourado M, Reese RM, Shields SD, Rouge L, Bravo DD, Chernov-Rogan T, Austin CD, Chen H, Wang L, Villemure E, Shore DGM, Verma VA, Hu B, Chen Y, Leong L, Bjornson C, Hotzel K, Gogineni A, Lee WP, Suto E, Wu X, Liu J, Zhang J, Gandham V, Wang J, Payandeh J, Ciferri C, Estevez A, Arthur CP, Kortmann J, Wong RL, Heredia JE, Doerr J, Jung M, Vander Heiden JA, Roose-Girma M, Tam L, Barck KH, Carano RAD, Ding HT, Brillantes B, Tam C, Yang X, Gao SS, Ly JQ, Liu L, Chen L, Liederer BM, Lin JH, Magnuson S, Chen J, Hackos DH, Elstrott J, Rohou A, Safina BS, Volgraf M, Bauer RN, Riol-Blanco L
J Exp Med (2021) 218 [ DOI: doi:10.1084/jem.20201637 Pubmed: 33620419 ]
- Transient receptor potential cation channel subfamily a member 1 (72 kDa, Protein from Homo sapiens)
- (4r,5s)-4-fluoro-1-[(4-fluorophenyl)sulfonyl]-5-methyl-n-({5-(trifluoromethyl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]pyridin-4-yl}methyl)-l-prolinamide (609 Da, Ligand)
- Trpa1 bound by inhibitor gdc-0334 (Complex from Homo sapiens)
Cryo-EM structure of a human-cockroach hybrid Nav channel bound to alpha-scorpion toxin AaH2.
Resolution: 3.5 Å
EM Method: Single-particle
Fitted PDBs: 6nt4
Q-score: 0.444
Clairfeuille T, Cloake A, Infield DT, Llongueras JP, Arthur CP, Li ZR, Jian Y, Martin-Eauclaire MF, Bougis PE, Ciferri C, Ahern CA, Bosmans F, Hackos DH, Rohou A, Payandeh J
Science (2019) 363 [ Pubmed: 30733386 DOI: doi:10.1126/science.aav8573 ]
- Alpha-mammal toxin aah2 (7 kDa, Protein from Androctonus australis)
- Cholesterol hemisuccinate (486 Da, Ligand)
- 1,2-dipalmitoyl-phosphatidyl-glycerole (722 Da, Ligand)
- Sodium channel protein pafpc1,sodium channel protein type 9 subunit alpha,sodium channel protein pafpc1 (178 kDa, Protein from Periplaneta americana)
- Digitonin (1 kDa, Ligand)
- Navpas-vsd4-aah2 (155 kDa, Complex from Periplaneta americana)
- (7e,21r,24s)-27-amino-24-hydroxy-18,24-dioxo-19,23,25-trioxa-24lambda~5~-phosphaheptacos-7-en-21-yl (9z,12e)-octadeca-9,12-dienoate (742 Da, Ligand)
- 2-acetamido-2-deoxy-beta-d-glucopyranose (221 Da, Ligand)
CryoEM structure of Nav1.7 VSD2 (actived state) in complex with the gating modifier toxin ProTx2
Resolution: 3.6 Å
EM Method: Single-particle
Fitted PDBs: 6n4q
Q-score: 0.343
Xu H, Li T, Rohou A, Arthur CP, Tzakoniati F, Wong E, Estevez A, Kugel C, Franke Y, Chen J, Ciferri C, Hackos DH, Koth CM, Payandeh J
Cell (2019) 176 pp. 702- [ DOI: doi:10.1016/j.cell.2018.12.018 Pubmed: 30661758 ]
- Nav1.7 vsd2-navab chimera (33 kDa, Protein from Arcobacter butzleri (strain RM4018))
- Nav1.7 vsd2 in complex with protx2 and an anti-nav fab (245 kDa, Complex from Homo sapiens)
- Fab heavy chain (24 kDa, Protein from Mus musculus)
- Fab light chain (23 kDa, Protein from Mus musculus)
- Beta/omega-theraphotoxin-tp2a (3 kDa, Protein from Thrixopelma pruriens)
CryoEM structure of Nav1.7 VSD2 (deactived state) in complex with the gating modifier toxin ProTx2
Resolution: 4.2 Å
EM Method: Single-particle
Fitted PDBs: 6n4r
Q-score: 0.345
Xu H, Li T, Rohou A, Arthur CP, Tzakoniati F, Wong E, Estevez A, Kugel C, Franke Y, Chen J, Ciferri C, Hackos DH, Koth CM, Payandeh J
Cell (2019) 176 pp. 702- [ DOI: doi:10.1016/j.cell.2018.12.018 Pubmed: 30661758 ]
- Nav1.7 vsd2-navab chimera (33 kDa, Protein from Arcobacter butzleri (strain RM4018))
- Nav1.7 vsd2 in complex with protx2 and an anti-nav fab (245 kDa, Complex from Homo sapiens)
- Fab heavy chain (24 kDa, Protein from Mus musculus)
- Fab light chain (23 kDa, Protein from Mus musculus)
- Beta/omega-theraphotoxin-tp2a (3 kDa, Protein from Thrixopelma pruriens)