Human transthyretin covalently modified with A2-derived stilbene in the canonical conformation
Resolution: 2.7 Å
EM Method: Single-particle
Fitted PDBs: 8ve1
Q-score: 0.607
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- 3-(dimethylamino)-5-[(e)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzoic acid (311 Da, Ligand)
- Transthyretin (13 kDa, Protein from Homo sapiens)
- Transthyretin (56 kDa, Complex from Homo sapiens)
- Water (18 Da, Ligand)
Unliganded human transthyretin in the canonical conformation
Resolution: 3.3 Å
EM Method: Single-particle
Fitted PDBs: 8ve2
Q-score: 0.485
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- Transthyretin (13 kDa, Protein from Homo sapiens)
- Transthyretin (55 kDa, Complex from Homo sapiens)
Unliganded human transthyretin in the compressed conformation
Resolution: 3.3 Å
EM Method: Single-particle
Fitted PDBs: 8ve3
Q-score: 0.498
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- Transthyretin (13 kDa, Protein from Homo sapiens)
- Transthyretin (55 kDa, Complex from Homo sapiens)
Unliganded human transthyretin in the frayed conformation
Resolution: 3.3 Å
EM Method: Single-particle
Fitted PDBs: 8ve4
Q-score: 0.477
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- Transthyretin (13 kDa, Protein from Homo sapiens)
- Transthyretin (55 kDa, Complex from Homo sapiens)
(Biarylamine-FT2-WT)1(C10A)3-human transthyretin in the compressed conformation
Resolution: 3.4 Å
EM Method: Single-particle
Fitted PDBs: 8ve5
Q-score: 0.489
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- Transthyretin (57 kDa, Complex from Homo sapiens)
- Transthyretin (15 kDa, Protein from Homo sapiens)
- 2-[(3,5-dichloro-4-trioxidanylphenyl)amino]benzoic acid (330 Da, Ligand)
(Biarylamine-FT2-WT)1(C10A)3-human transthyretin in the frayed conformation
Resolution: 4.1 Å
EM Method: Single-particle
Fitted PDBs: 8ve6
Q-score: 0.447
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- Transthyretin (15 kDa, Protein from Homo sapiens)
- 2-[(3,5-dichloro-4-trioxidanylphenyl)amino]benzoic acid (330 Da, Ligand)
- Transthyretin (57 kDa, Complex from Homo sapiens)
Human transthyretin covalently modified with A2-derived stilbene in the compressed conformation
Resolution: 3.1 Å
EM Method: Single-particle
Fitted PDBs: 8ve0
Q-score: 0.529
Basanta B, Nugroho K, Yan NL, Kline GM, Powers ET, Tsai FJ, Wu M, Hansel-Harris A, Chen JS, Forli S, Kelly JW, Lander GC
Nat Struct Mol Biol (2025) [ Pubmed: 39843982 DOI: doi:10.1038/s41594-024-01472-7 ]
- Transthyretin (13 kDa, Protein from Homo sapiens)
- Transthyretin (56 kDa, Complex from Homo sapiens)
- 3-(dimethylamino)-5-[(e)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzoic acid (311 Da, Ligand)
CD4- and 17-bound HIV-1 Env B41 SOSIP in complex with small molecule GO35
Resolution: 3.5 Å
EM Method: Single-particle
Fitted PDBs: 6opn
Q-score: 0.386
Ozorowski G, Torres JL, Santos-Martins D, Forli S, Ward AB
Cell Rep (2020) 33 pp. 108428-108428 [ DOI: doi:10.1016/j.celrep.2020.108428 Pubmed: 33238117 ]
- [3'-(5-methyl-1,3,4-oxadiazol-2-yl)[1,1'-biphenyl]-3-yl](piperidin-1-yl)methanone (347 Da, Ligand)
- Cd4- and 17b-bound hiv-1 env b41 sosip in complex with small molecule go35 (50 kDa, Complex from Human immunodeficiency virus 1)
- Envelope glycoprotein gp41 (17 kDa, Protein from Human immunodeficiency virus 1)
- 2-acetamido-2-deoxy-beta-d-glucopyranose (221 Da, Ligand)
- Envelope glycoprotein gp160 (58 kDa, Protein from Human immunodeficiency virus 1)
- T-cell surface glycoprotein cd4 (23 kDa, Protein from Homo sapiens)
- 17b fragment antigen binding (Complex)
C3 symmetry reconstruction of CD4- and 17-bound B41 HIV-1 Env SOSIP in complex with DDM
Resolution: 3.5 Å
EM Method: Single-particle
Fitted PDBs: 6opo
Q-score: 0.448
Ozorowski G, Torres JL, Santos-Martins D, Forli S, Ward AB
Cell Rep (2020) 33 pp. 108428-108428 [ DOI: doi:10.1016/j.celrep.2020.108428 Pubmed: 33238117 ]
- 17b fab heavy chain (24 kDa, Protein from Homo sapiens)
- Envelope glycoprotein gp41 (17 kDa, Protein from Human immunodeficiency virus 1)
- Dodecyl-beta-d-maltoside (510 Da, Ligand)
- 2-acetamido-2-deoxy-beta-d-glucopyranose (221 Da, Ligand)
- Hiv-1 env b41 sosip in complex with soluble cd4, 17b fab and ddm (630 kDa, Complex from Human immunodeficiency virus 1)
- Envelope glycoprotein gp160 (58 kDa, Protein from Human immunodeficiency virus 1)
- T-cell surface glycoprotein cd4 (23 kDa, Protein from Homo sapiens)
- 17b fab light chain (23 kDa, Protein from Homo sapiens)
Asymmetric reconstruction of CD4- and 17-bound B41 HIV-1 Env SOSIP in complex with DDM
Resolution: 3.7 Å
EM Method: Single-particle
Fitted PDBs: 6opp
Q-score: 0.411
Ozorowski G, Torres JL, Santos-Martins D, Forli S, Ward AB
Cell Rep (2020) 33 pp. 108428-108428 [ DOI: doi:10.1016/j.celrep.2020.108428 Pubmed: 33238117 ]
- 17b fab heavy chain (24 kDa, Protein from Homo sapiens)
- Envelope glycoprotein gp41 (17 kDa, Protein from Human immunodeficiency virus 1)
- Dodecyl-beta-d-maltoside (510 Da, Ligand)
- 2-acetamido-2-deoxy-beta-d-glucopyranose (221 Da, Ligand)
- Hiv-1 env b41 sosip in complex with soluble cd4, 17b fab and ddm (630 kDa, Complex from Human immunodeficiency virus 1)
- Envelope glycoprotein gp160 (58 kDa, Protein from Human immunodeficiency virus 1)
- T-cell surface glycoprotein cd4 (23 kDa, Protein from Homo sapiens)
- 17b fab light chain (23 kDa, Protein from Homo sapiens)