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6DMP
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BU of 6dmp by Molmil
De Novo Design of a Protein Heterodimer with Specificity Mediated by Hydrogen Bond Networks
Descriptor: Designed orthogonal protein DHD13_XAAA_A, Designed orthogonal protein DHD13_XAAA_B
Authors:Chen, Z, Flores-Solis, D, Sgourakis, N.G, Baker, D.
Deposit date:2018-06-05
Release date:2018-12-19
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Programmable design of orthogonal protein heterodimers.
Nature, 565, 2019
9BK6
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BU of 9bk6 by Molmil
Structure of B10_CYTX binder-complex
Descriptor: B10_CYTX binder, Cytotoxin 1
Authors:Bera, A.K, Torres, S.V, Kang, A, Baker, D.
Deposit date:2024-04-26
Release date:2024-10-09
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (2 Å)
Cite:De novo designed proteins neutralize lethal snake venom toxins.
Nature, 639, 2025
9BK7
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BU of 9bk7 by Molmil
Structure of SHRT_binder
Descriptor: SHRT_binder
Authors:Bera, A.K, Torres, S.V, Kang, A, Baker, D.
Deposit date:2024-04-26
Release date:2024-10-09
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (2.58 Å)
Cite:De novo designed proteins neutralize lethal snake venom toxins.
Nature, 639, 2025
9BK5
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BU of 9bk5 by Molmil
Structure of LNG binder complex
Descriptor: Alpha-cobratoxin, LNG binder
Authors:Bera, A.K, Torres, S.V, Kang, A, Baker, D.
Deposit date:2024-04-26
Release date:2024-10-09
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (2.68 Å)
Cite:De novo designed proteins neutralize lethal snake venom toxins.
Nature, 639, 2025
9CC5
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BU of 9cc5 by Molmil
De novo design of high-affinity protein binders to bio active peptide Amylin
Descriptor: Amylin-NHO-22 Binder, Islet amyloid polypeptide
Authors:Bera, A.K, Liu, C, Kang, A, Baker, D.
Deposit date:2024-06-20
Release date:2025-05-14
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Diffusing protein binders to intrinsically disordered proteins
To Be Published
9CC6
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BU of 9cc6 by Molmil
De novo design of high-affinity protein binders to RNA binding domain of G3bp1
Descriptor: G3bp1 Binder, Ras GTPase-activating protein-binding protein 1
Authors:Bera, A.K, Liu, C, Kang, A, Baker, D.
Deposit date:2024-06-20
Release date:2025-05-14
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Diffusing protein binders to intrinsically disordered proteins
To Be Published
9CU8
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BU of 9cu8 by Molmil
Crystal Structure of TNFR2 TNFR2_mb1 Complex
Descriptor: TNFR2_mb1, Tumor necrosis factor receptor superfamily member 1B
Authors:Bera, A.K, Glogl, M, Baker, D.
Deposit date:2024-07-26
Release date:2024-12-04
Last modified:2024-12-18
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Target-conditioned diffusion generates potent TNFR superfamily antagonists and agonists.
Science, 386, 2024
9DTE
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BU of 9dte by Molmil
Crystal Structure of C2-02802
Descriptor: C2-02802
Authors:Bera, A.K, Schlichthaerle, T, Kang, A, Baker, D.
Deposit date:2024-09-30
Release date:2025-04-23
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:De novo design of TrkA specific agonists
To Be Published
9DT9
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BU of 9dt9 by Molmil
Crystal Structure of 231_C2_TrkA
Descriptor: 231_C2_TrkA
Authors:Bera, A.K, Schlichthaerle, T, Kang, A, Baker, D.
Deposit date:2024-09-30
Release date:2025-04-23
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:De novo design of TrkA specific agonists
To Be Published
9DTD
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BU of 9dtd by Molmil
Crystal Structure of C2-01018
Descriptor: C2-01018
Authors:Bera, A.K, Schlichthaerle, T, Kang, A, Baker, D.
Deposit date:2024-09-30
Release date:2025-04-23
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:De novo design of TrkA specific agonists
To Be Published
9CC4
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BU of 9cc4 by Molmil
Crystal structure of Z4 c3ii
Descriptor: Z4 c3ii
Authors:Bera, A.K, Pyles, H, Saragovi, A, Kang, A, Baker, D.
Deposit date:2024-06-20
Release date:2025-06-25
Method:X-RAY DIFFRACTION (2.99 Å)
Cite:Design of defined protein-semiconductor nano complexes
To Be Published
7LMX
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BU of 7lmx by Molmil
A HIGHLY SPECIFIC INHIBITOR OF INTEGRIN ALPHA-V BETA-6 WITH A DISULFIDE
Descriptor: Integrin inhibitor
Authors:Dong, X, Bera, A.K, Roy, A, Shi, L, Springer, T.A, Baker, D.
Deposit date:2021-02-06
Release date:2022-08-10
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:De novo design of highly selective miniprotein inhibitors of integrins alpha v beta 6 and alpha v beta 8.
Nat Commun, 14, 2023
7LMV
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BU of 7lmv by Molmil
SPECIFIC INHIBITOR OF INTEGRIN ALPHA-V BETA-6
Descriptor: Integrin inhibitor
Authors:Dong, X, Bera, A.K, Roy, A, Shi, L, Springer, T.A, Baker, D.
Deposit date:2021-02-05
Release date:2022-08-10
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:De novo design of highly selective miniprotein inhibitors of integrins alpha v beta 6 and alpha v beta 8.
Nat Commun, 14, 2023
6XSS
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BU of 6xss by Molmil
CryoEM structure of designed helical fusion protein C4_nat_HFuse-7900
Descriptor: C4_nat_HFuse-7900
Authors:Redler, R.L, Edman, N.I, Baker, D, Ekiert, D, Bhabha, G.
Deposit date:2020-07-16
Release date:2020-12-23
Last modified:2024-03-06
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Design of multi-scale protein complexes by hierarchical building block fusion.
Nat Commun, 12, 2021
6XNS
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BU of 6xns by Molmil
C3_crown-05
Descriptor: C3_crown-05
Authors:Bick, M.J, Hsia, Y, Sankaran, B, Baker, D.
Deposit date:2020-07-04
Release date:2020-12-23
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (3.19 Å)
Cite:Design of multi-scale protein complexes by hierarchical building block fusion.
Nat Commun, 12, 2021
6XI6
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BU of 6xi6 by Molmil
Hierarchical design of multi-scale protein complexes by combinatorial assembly of oligomeric helical bundle and repeat protein building blocks
Descriptor: helical fusion design
Authors:Bera, A.K, Hsia, Y, Kang, A.S, Shankaran, B, Baker, D.
Deposit date:2020-06-19
Release date:2021-06-02
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.69 Å)
Cite:Design of multi-scale protein complexes by hierarchical building block fusion.
Nat Commun, 12, 2021
6XH5
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BU of 6xh5 by Molmil
Hierarchical design of multi-scale protein complexes by combinatorial assembly of oligomeric helical bundle and repeat protein building blocks
Descriptor: helical fusion design
Authors:Bera, A.K, Hsia, Y, Kang, A.S, Baker, D.
Deposit date:2020-06-18
Release date:2021-06-02
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (3.32 Å)
Cite:Design of multi-scale protein complexes by hierarchical building block fusion.
Nat Commun, 12, 2021
8TCF
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BU of 8tcf by Molmil
Integrin alpha-v beta-8 in complex with minibinder B8_BP_dsulf
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
Authors:Campbell, M.G, Fernandez, A, Roy, A, Kraft, J, Baker, D.
Deposit date:2023-06-30
Release date:2023-09-27
Last modified:2024-11-06
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:De novo design of highly selective miniprotein inhibitors of integrins alpha v beta 6 and alpha v beta 8.
Nat Commun, 14, 2023
8TCG
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BU of 8tcg by Molmil
Integrin alpha-v beta-6 in complex with minibinder B6_BP_dslf
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, Integrin alpha-V heavy chain, ...
Authors:Campbell, M.G, Fernandez, A, Roy, A, Kraft, J, Baker, D.
Deposit date:2023-06-30
Release date:2023-09-27
Last modified:2024-11-06
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:De novo design of highly selective miniprotein inhibitors of integrins alpha v beta 6 and alpha v beta 8.
Nat Commun, 14, 2023
6ZV9
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BU of 6zv9 by Molmil
Terbium(III)-bound de novo TIM barrel-ferredoxin fold fusion dimer with 4-glutamate binding site and tryptophan antenna (TFD-EE N6W)
Descriptor: 1,2-ETHANEDIOL, TERBIUM(III) ION, TFD-EE
Authors:Caldwell, S, Haydon, I, Piperidou, N, Huang, P, Hilvert, D, Baker, D, Zeymer, C.
Deposit date:2020-07-24
Release date:2020-11-25
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Tight and specific lanthanide binding in a de novo TIM barrel with a large internal cavity designed by symmetric domain fusion.
Proc.Natl.Acad.Sci.USA, 117, 2020
8CWY
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BU of 8cwy by Molmil
Accurate computational design of genetically encoded 3D protein crystals
Descriptor: T32-15-1, T32-15-2
Authors:Li, Z, Borst, A.J, Baker, D.
Deposit date:2022-05-19
Release date:2023-11-01
Last modified:2023-12-20
Method:ELECTRON MICROSCOPY (3.34 Å)
Cite:Accurate computational design of three-dimensional protein crystals.
Nat Mater, 22, 2023
8CUS
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BU of 8cus by Molmil
Accurate computational design of genetically encoded 3D protein crystals
Descriptor: I432-1(NaCl) Chain A, I432-1(NaCl) Chain B
Authors:Bera, A.K, Li, Z, Baker, D.
Deposit date:2022-05-17
Release date:2023-11-01
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (3.98 Å)
Cite:Accurate computational design of three-dimensional protein crystals.
Nat Mater, 22, 2023
8CUT
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BU of 8cut by Molmil
Accurate computational design of genetically encoded 3D protein crystals
Descriptor: I432-1(Imd) Chain A, I432-1(Imd) Chain B
Authors:Bera, A.K, Li, Z, Baker, D.
Deposit date:2022-05-17
Release date:2023-11-01
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (4 Å)
Cite:Accurate computational design of three-dimensional protein crystals.
Nat Mater, 22, 2023
8CUX
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BU of 8cux by Molmil
Accurate computational design of genetically encoded 3D protein crystals
Descriptor: R3-1 Chain B
Authors:Bera, A.K, Natterman, U, Baker, D.
Deposit date:2022-05-17
Release date:2023-11-01
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Accurate computational design of three-dimensional protein crystals.
Nat Mater, 22, 2023
8CWZ
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BU of 8cwz by Molmil
Accurate computational design of genetically encoded 3D protein crystals
Descriptor: I432-1-X3 Chain A, I432-1-X3 Chain B
Authors:Bera, A.K, Li, Z, Baker, D.
Deposit date:2022-05-19
Release date:2023-11-01
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (5.53 Å)
Cite:Accurate computational design of three-dimensional protein crystals.
Nat Mater, 22, 2023

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