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Abeta 16-36 beta-hairpin mimic with E22K Italian mutation
Descriptor:	Abeta 16-36 beta-hairpin mimic VAL-ORT-LYS-LEU-VAL-MEA-PHE-ALA-LYS-ORT-ALA-ILE-ILE-GLY-LEU-MET
Authors:	Kreutzer, A.G, McKnelly, K.J, Nowick, J.S.
Deposit date:	2020-08-11
Release date:	2021-09-08
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (2.08 Å)
Cite:	Effects of Familial Alzheimer's Disease Mutations on the Assembly of a beta-Hairpin Peptide Derived from A beta 16-36 . Biochemistry, 61, 2022

7RTZ

X-ray crystallographic structure of a beta-hairpin peptide derived from amyloid beta 14-40
Descriptor:	Amyloid-beta protein 40, CHLORIDE ION
Authors:	Samdin, T.D, Kreutzer, A.G, Nowick, J.S.
Deposit date:	2021-08-16
Release date:	2022-08-31
Last modified:	2023-12-13
Method:	X-RAY DIFFRACTION (2.1 Å)
Cite:	A beta-Barrel-Like Tetramer Formed by a beta-Hairpin Derived From A beta Chem Sci, 2023

5HPP

Crystal structure of a macrocyclic beta-sheet peptide derived from transthyretin (106-121) - (ORN)TIA(MAA)LLS(ORN)S(PHI)STTAV
Descriptor:	CHLORIDE ION, ORN-THR-ILE-ALA-MAA-LEU-LEU-SER-ORN-SER-PHI-SER-THR-THR-ALA-VAL
Authors:	Yoo, S, Kreutzer, A.G, Nowick, J.S.
Deposit date:	2016-01-20
Release date:	2016-08-10
Last modified:	2019-12-25
Method:	X-RAY DIFFRACTION (2.082 Å)
Cite:	Square channels formed by a peptide derived from transthyretin. Chem Sci, 7, 2016

8U78

Structure of a N-Me-D-Gln4,Lys10-teixobactin analogue
Descriptor:	1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE, CHLORIDE ION, N-Methyl-D-Gln4,Lys10-teixobactin
Authors:	Nowick, J.S, Yang, H, Kreutzer, A.G.
Deposit date:	2023-09-14
Release date:	2024-03-06
Last modified:	2024-04-17
Method:	X-RAY DIFFRACTION (1.5 Å)
Cite:	Supramolecular Interactions of Teixobactin Analogues in the Crystal State. J.Org.Chem., 89, 2024

5UHR

Crystal structure of (Cit)LANFLV heptapeptide segment from islet amyloid polypeptide (IAPP) incorporated into a macrocyclic beta-sheet template
Descriptor:	CHLORIDE ION, ORN-CIR-LEU-ALA-ASN-PHE-LEU-VAL-ORN-ILE-LYS-HAO-LYS-A8E
Authors:	Wang, Y, Kreutzer, A.G, Nowick, J.S.
Deposit date:	2017-01-11
Release date:	2017-07-12
Last modified:	2023-11-15
Method:	X-RAY DIFFRACTION (1.798 Å)
Cite:	A Tetramer Derived from Islet Amyloid Polypeptide. J. Org. Chem., 82, 2017

4WC8

Heterogeneous dodecamer formed from macrocycles containing a sequence from beta-2-microglobulin(63-69).
Descriptor:	CHLORIDE ION, ORN-TYR-LEU-LEU-PHI-TYR-THR-GLU-ORN-LYS-VAL-ALA-MAA-ALA-VAL-LYS, ORN-TYR-LEU-LEU-PHI-TYR-THR-GLU-ORN-LYS-VAL-ALA-MLE-ALA-VAL-LYS, ...
Authors:	Spencer, R.K, Nowick, J.S.
Deposit date:	2014-09-04
Release date:	2015-05-06
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.908 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

6DR4

X-ray crystallographic structure of a covalent trimer derived from A-beta 17_36 containing the I31V point mutation
Descriptor:	HEXANE-1,6-DIOL, ORN-CYS-VAL-PHE-MEA-CYS-GLU-ASP-ORN-ALA-VAL-ILE-GLY-LEU-ORN-VAL
Authors:	Salveson, P.J, Nowick, J.S.
Deposit date:	2018-06-11
Release date:	2018-10-17
Last modified:	2020-01-01
Method:	X-RAY DIFFRACTION (2.105 Å)
Cite:	Repurposing Triphenylmethane Dyes to Bind to Trimers Derived from A beta. J. Am. Chem. Soc., 140, 2018

6DR6

X-ray crystallographic structure of a covalent trimer derived from A-beta 17_36 containing the F20Cha point mutation
Descriptor:	ORT-CYS-VAL-PHE-XXX-CYS-GLU-ASP-ORT-ALA-ILE-ILE-GLY-LEU-ORA-VAL
Authors:	Salveson, P.J, Nowick, J.S.
Deposit date:	2018-06-11
Release date:	2018-10-17
Last modified:	2020-01-01
Method:	X-RAY DIFFRACTION (2.608 Å)
Cite:	Repurposing Triphenylmethane Dyes to Bind to Trimers Derived from A beta. J. Am. Chem. Soc., 140, 2018

4P4W

Dodecamer formed by a macrocyclic peptide derived from beta-2-microglobulin (63-69) - (ORN)YLL(PHI)YTE(ORN)KVA(MVA)AVK
Descriptor:	CHLORIDE ION, CYCLIC HEXADECAPEPTIDE (ORN)YLL(PHI)YTE(ORN)KVA(MVA)AVK, SODIUM ION, ...
Authors:	Spencer, R.K, Kreutzer, A, Nowick, J.S.
Deposit date:	2014-03-13
Release date:	2015-05-06
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.498 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

4X0S

Hexamer formed by a macrocycle containing a sequence from beta-2-microglobulin (63-69).
Descriptor:	CHLORIDE ION, ORN-TYR-LEU-LEU-PHI-TYR-VAL-GLU-ORN-LYS-VAL-ALA-MAA-ALA-VAL-LYS, SODIUM ION, ...
Authors:	Spencer, R.K, Salveson, P.J, Nowick, J.S.
Deposit date:	2014-11-23
Release date:	2015-05-06
Last modified:	2019-12-25
Method:	X-RAY DIFFRACTION (2.032 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

6VU4

Structure of a beta-hairpin peptide mimic derived from Abeta 14-36
Descriptor:	Beta-hairpin Amyloid-beta precursor peptide mimic, CHLORIDE ION, IODIDE ION
Authors:	Wierzbicki, M, Kreutzer, A, Samdin, T, Nowick, J.S.
Deposit date:	2020-02-14
Release date:	2020-06-17
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.077 Å)
Cite:	Effects of N-Terminal Residues on the Assembly of Constrained beta-Hairpin Peptides Derived from A beta. J.Am.Chem.Soc., 142, 2020

6CG3

Macrocyclic peptide derived from Abeta(17-36) - (ORN)LV(PHI)FAED(ORN)AII(2-nitrobenzylglycine)L(ORN)V
Descriptor:	ORN-LEU-VAL-PHI-PHE-ALA-GLU-ASP-ORN-ALA-ILE-ILE-EZY-LEU-ORN-VAL
Authors:	Salveson, P.J, Nowick, J.S.
Deposit date:	2018-02-19
Release date:	2018-05-16
Last modified:	2020-01-01
Method:	X-RAY DIFFRACTION (2.03 Å)
Cite:	Controlling the Oligomerization State of A beta-Derived Peptides with Light. J. Am. Chem. Soc., 140, 2018

6CG5

Covalently crosslinked trimer of a macrocyclic peptide derived from Abeta (17-36) - (ORN)LCVFFCED(ORN)AII(2-nitrobenzylglycine)L(ORN)V
Descriptor:	ORN-CYS-VAL-PHE-PHE-CYS-GLU-ASP-ORN-ALA-ILE-ILE-EZY-LEU-ORN-VAL
Authors:	Salveson, P.J, Nowick, J.S.
Deposit date:	2018-02-19
Release date:	2018-05-16
Last modified:	2024-04-03
Method:	X-RAY DIFFRACTION (2.08 Å)
Cite:	Controlling the Oligomerization State of A beta-Derived Peptides with Light. J. Am. Chem. Soc., 140, 2018

6CG4

Covalently crosslinked trimer of a macrocyclic peptide derived from Abeta(17-36) - (ORN)LCVFFCED(ORN)AII(2-nitrobenzylglycine)L(ORN)V
Descriptor:	(4S)-2-METHYL-2,4-PENTANEDIOL, IODIDE ION, ORN-CYS-VAL-PHE-PHE-CYS-GLU-ASP-ORN-ALA-ILE-ILE-EZY-LEU-ORN-VAL
Authors:	Salveson, P.J, Nowick, J.S.
Deposit date:	2018-02-19
Release date:	2018-05-16
Last modified:	2020-01-01
Method:	X-RAY DIFFRACTION (2.083 Å)
Cite:	Controlling the Oligomerization State of A beta-Derived Peptides with Light. J. Am. Chem. Soc., 140, 2018

5V63

Crystal structure of macrocycles containing Abeta 16-22 (KLV(PHI)FAE) and Abeta 30-36 (AII(SAR)L(ORN)V)
Descriptor:	ORN-LYS-LEU-VAL-PHI-PHE-ALA-GLU-ORN-ALA-ILE-ILE-SAR-LEU-MET-VAL
Authors:	Spencer, R.K, Salveson, P.J, Nowick, J.S.
Deposit date:	2017-03-15
Release date:	2017-06-28
Last modified:	2020-01-01
Method:	X-RAY DIFFRACTION (2.091 Å)
Cite:	X-ray Crystallographic Structure of a Compact Dodecamer from a Peptide Derived from A beta 16-36. Org. Lett., 19, 2017

6DR5

X-ray crystallographic structure of a covalent trimer derived from A-beta 17_36 containing the I31Chg point mutation
Descriptor:	(4S)-2-METHYL-2,4-PENTANEDIOL, ORT-CYS-VAL-PHE-MEA-CYS-GLU-ASP-ORT-ALA-CHG-ILE-GLY-LEU-ORA-VAL
Authors:	Salveson, P.J, Nowick, J.S.
Deposit date:	2018-06-11
Release date:	2018-10-17
Last modified:	2023-11-15
Method:	X-RAY DIFFRACTION (2.079 Å)
Cite:	Repurposing Triphenylmethane Dyes to Bind to Trimers Derived from A beta. J. Am. Chem. Soc., 140, 2018

5V64

Crystal structure of macrocycles containing Abeta 15-21 (QKLV(PHI)FA) and Abeta 30-36 (AII(SAR)L(ORN)V)
Descriptor:	CITRATE ANION, ORN-GLN-LYS-LEU-VAL-PHI-PHE-ALA-ORN-ALA-ILE-ILE-SAR-LEU-MET-VAL, SODIUM ION
Authors:	Salveson, P.J, Spencer, R.K, Nowick, J.S.
Deposit date:	2017-03-15
Release date:	2017-06-28
Last modified:	2020-01-01
Method:	X-RAY DIFFRACTION (2.023 Å)
Cite:	X-ray Crystallographic Structure of a Compact Dodecamer from a Peptide Derived from A beta 16-36. Org. Lett., 19, 2017

4P4X

Dodecamer formed by a macrocyclic peptide derived from beta-2-microglobulin (63-69) - (ORN)YLL(PHI)YTE(ORN)KVA(MLE)AVK
Descriptor:	CHLORIDE ION, CYCLIC HEXADECAPEPTIDE (ORN)YLL(PH7)YTE(ORN)KVA(MLE)AVK, SULFATE ION
Authors:	Spencer, R.K, Nowick, J.S.
Deposit date:	2014-03-13
Release date:	2015-05-06
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.898 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

4P4V

Hexamer formed by a macrocyclic peptide derived from beta-2-microglobulin (63-69) - (ORN)YLL(PHI)YTE(ORN)KVA(MAA)AVK
Descriptor:	CHLORIDE ION, CYCLIC HEXADECAPEPTIDE (ORN)YLL(PHI)YTE(ORN)KVA(MAA)AVK, SULFATE ION
Authors:	Spencer, R.K, Nowick, J.S.
Deposit date:	2014-03-13
Release date:	2015-05-06
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.97 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

4P4Z

Octomer formed by a macrocyclic peptide derived from beta-2-microglobulin (63-69) - (ORN)YLL(PHI)YTE(ORN)KVT(MVA)TVK
Descriptor:	CYCLIC HEXADECAPEPTIDE (ORN)YLL(PHI)YTE(ORN)KVT(MVA)TVK, PHOSPHATE ION, SODIUM ION
Authors:	Spencer, R.K, Nowick, J.S.
Deposit date:	2014-03-13
Release date:	2015-05-06
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.31 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

4P4Y

Hexamer formed by a macrocyclic peptide derived from beta-2-microglobulin (63-69) - (ORN)YLL(PHI)YTE(ORN)KVT(MAA)TVK
Descriptor:	CHLORIDE ION, CYCLIC HEXADECAPEPTIDE (ORN)YLL(PHI)YTE(ORN)KVT(MAA)TVK, SULFATE ION
Authors:	Spencer, R.K, Li, H, Nowick, J.S.
Deposit date:	2014-03-13
Release date:	2015-05-06
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.509 Å)
Cite:	X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015

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