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Plasmodium falciparum dUTPase in complex with a trityl ligand
Descriptor:	(2S)-2-[(2,4-dioxopyrimidin-1-yl)methyl]-N-(2-hydroxyethyl)-4-trityloxy-butanamide, DEOXYURIDINE 5'-TRIPHOSPHATE NUCLEOTIDOHYDROLASE, SULFATE ION
Authors:	Baragana, B, McCarthy, O, Sanchez, P, Bosch, C, Kaiser, M, Brun, R, Whittingham, J.L, Roberts, S, Zhou, X.-X, Wilson, K.S, Johansson, N.G, Gonzalez-Pacanowska, D, Gilbert, I.H.
Deposit date:	2011-02-04
Release date:	2012-03-07
Last modified:	2023-12-20
Method:	X-RAY DIFFRACTION (2.1 Å)
Cite:	Beta-Branched Acyclic Nucleoside Analogues as Inhibitors of Plasmodium Falciparum Dutpase Bioorg.Med.Chem., 19, 2011

8SPK

Crystal structure of Antarctic PET-degrading enzyme
Descriptor:	Lipase 1, MALONATE ION
Authors:	Furtado, A.A, Blazquez-Sanchez, P, Grinen, A, Vargas, J.A, Leonardo, D.A, Sculaccio, S.A, Pereira, H.M, Diez, B, Garratt, R.C, Ramirez-Sarmiento, C.A.
Deposit date:	2023-05-03
Release date:	2023-08-23
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (1.6 Å)
Cite:	Engineering the catalytic activity of an Antarctic PET-degrading enzyme by loop exchange. Protein Sci., 32, 2023

8VU6

Wheat Germ Agglutinin (WGA) domain A
Descriptor:	Agglutinin isolectin 1
Authors:	Titaux-Delgado, G.A, del Rio-Portilla, F, Garcia-Hernandez, E.
Deposit date:	2024-01-29
Release date:	2024-06-05
Method:	SOLUTION NMR
Cite:	Decoding the mechanism governing the structural stability of wheat germ agglutinin and its isolated domains: A combined calorimetric, NMR, and MD simulation study. Protein Sci., 33, 2024

8VU7

Wheat Germ Agglutinin (WGA) domain C
Descriptor:	Agglutinin isolectin 1
Authors:	Melchor-Meneses, C.M, del Rio-Portilla, F, Garcia-Hernandez, E.
Deposit date:	2024-01-29
Release date:	2024-06-05
Method:	SOLUTION NMR
Cite:	Decoding the mechanism governing the structural stability of wheat germ agglutinin and its isolated domains: A combined calorimetric, NMR, and MD simulation study. Protein Sci., 33, 2024

8VU8

Wheat Germ Agglutinin (WGA) domain D
Descriptor:	Agglutinin isolectin 3
Authors:	Titaux-Delgado, G.A, del Rio-Portilla, F, Garcia-Hernandez, E.
Deposit date:	2024-01-29
Release date:	2024-06-05
Method:	SOLUTION NMR
Cite:	Decoding the mechanism governing the structural stability of wheat germ agglutinin and its isolated domains: A combined calorimetric, NMR, and MD simulation study. Protein Sci., 33, 2024

5FDS

Crystal structure of the monomeric allergen profilin (Hev b 8)
Descriptor:	GLYCEROL, Profilin-2, SULFATE ION
Authors:	Mares-Mejia, I, Rodriguez-Romero, A.
Deposit date:	2015-12-16
Release date:	2016-09-14
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Structural insights into the IgE mediated responses induced by the allergens Hev b 8 and Zea m 12 in their dimeric forms. Sci Rep, 6, 2016

5FEG

Crystal structure of the dimeric allergen profilin (Hev b 8)
Descriptor:	Profilin-2
Authors:	Mares-Mejia, I, Rodriguez-Romero, A.
Deposit date:	2015-12-17
Release date:	2016-09-14
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.802 Å)
Cite:	Structural insights into the IgE mediated responses induced by the allergens Hev b 8 and Zea m 12 in their dimeric forms. Sci Rep, 6, 2016

5FEF

Crystal structure of the allergen profilin (Zea m 12)
Descriptor:	GLYCEROL, Profilin-5
Authors:	Mares-Mejia, I, Rodriguez-Romero, A.
Deposit date:	2015-12-16
Release date:	2016-09-14
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Structural insights into the IgE mediated responses induced by the allergens Hev b 8 and Zea m 12 in their dimeric forms. Sci Rep, 6, 2016

8F54

Top-down design of protein architectures with reinforcement learning
Descriptor:	RC_I_1
Authors:	Borst, A.J, Baker, D.
Deposit date:	2022-11-11
Release date:	2023-05-10
Method:	ELECTRON MICROSCOPY (2.5 Å)
Cite:	Top-down design of protein architectures with reinforcement learning. Science, 380, 2023

8F53

Top-down design of protein architectures with reinforcement learning
Descriptor:	RC_I_2
Authors:	Borst, A.J, Baker, D.
Deposit date:	2022-11-11
Release date:	2023-05-10
Method:	ELECTRON MICROSCOPY (2.93 Å)
Cite:	Top-down design of protein architectures with reinforcement learning. Science, 380, 2023

8F4X

Top-down design of protein architectures with reinforcement learning
Descriptor:	RC_I_1-H11
Authors:	Borst, A.J, Baker, D.
Deposit date:	2022-11-11
Release date:	2023-05-10
Method:	ELECTRON MICROSCOPY (3.01 Å)
Cite:	Top-down design of protein architectures with reinforcement learning. Science, 380, 2023

7NEI

Polyester Hydrolase Leipzig 7 (PHL7) in the unliganded state
Descriptor:	Polyester Hydrolase Leipzig 7 (PHL-7), SODIUM ION
Authors:	Richter, P.K, Strater, N.
Deposit date:	2021-02-04
Release date:	2021-06-23
Last modified:	2024-05-01
Method:	X-RAY DIFFRACTION (1.3 Å)
Cite:	Low Carbon Footprint Recycling of Post-Consumer PET Plastic with a Metagenomic Polyester Hydrolase. ChemSusChem, 15, 2022

4MPI

Crystal structure of the chitin-binding module (CBM18) of a chitinase-like protein from Hevea brasiliensis
Descriptor:	1,4-DIETHYLENE DIOXIDE, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Class I chitinase
Authors:	Martinez-Caballero, C.S, Hermoso, J.A, Rodriguez-Romero, A.
Deposit date:	2013-09-12
Release date:	2014-08-27
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.602 Å)
Cite:	Comparative study of two GH19 chitinase-like proteins from Hevea brasiliensis, one exhibiting a novel carbohydrate-binding domain. Febs J., 281, 2014

4MST

Crystal Structure of a putative catalytic domain of a chitinase-like protein (HbCLP1) from Hevea brasiliensis
Descriptor:	CHLORIDE ION, class I chitinase
Authors:	Martinez-Caballero, S, Hermoso, J.A, Rodriguez-Romero, A.
Deposit date:	2013-09-18
Release date:	2014-08-27
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.927 Å)
Cite:	Comparative study of two GH19 chitinase-like proteins from Hevea brasiliensis, one exhibiting a novel carbohydrate-binding domain. Febs J., 281, 2014

7M1E

Structural and functional studies about scorpine showed the presence of blocking channel and cytolytic activities as well as two different structural domains
Descriptor:	Scorpine
Authors:	del Rio, J.F, Lopez, A.E, Titaux, G.
Deposit date:	2021-03-12
Release date:	2022-01-19
Last modified:	2024-05-15
Method:	SOLUTION NMR
Cite:	Structural and functional studies of scorpine: A channel blocker and cytolytic peptide. Toxicon, 222, 2022

7M1D

Structural and functional studies about scorpine showed the presence of blocking channel and cytolytic activities as well as two different structural domains
Descriptor:	Scorpine
Authors:	del Rio-Portilla, F, Lopez-Giraldo, A.E.
Deposit date:	2021-03-12
Release date:	2022-01-19
Last modified:	2023-06-14
Method:	SOLUTION NMR
Cite:	Structural and functional studies of scorpine: A channel blocker and cytolytic peptide. Toxicon, 222, 2022

5VBK

Crystal structure of a galactose-binding Lectin from Mytilus californianus
Descriptor:	GLYCEROL, Lectin
Authors:	Hernandez-Santoyo, A, Garcia-Maldonado, E.
Deposit date:	2017-03-29
Release date:	2017-06-07
Last modified:	2023-10-04
Method:	X-RAY DIFFRACTION (1.788 Å)
Cite:	Molecular and functional characterization of a glycosylated Galactose-Binding lectin from Mytilus californianus. Fish Shellfish Immunol., 66, 2017

6H6A

Crystal structure of UNC119 in complex with LCK peptide
Descriptor:	GLY-CYS-GLY-CYS-SER-SER, GLYCEROL, MYRISTIC ACID, ...
Authors:	Yelland, T, ElMaghloob, Y, McIlwraith, M, Stephen, L, Ismail, S.
Deposit date:	2018-07-26
Release date:	2018-09-26
Last modified:	2019-11-27
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	The Ciliary Machinery Is Repurposed for T Cell Immune Synapse Trafficking of LCK. Dev.Cell, 47, 2018

5JYH

Solution Structure of Hge36: Scorpine-like Peptide from Hadrurus Gertschi
Descriptor:	Hge-scorpine
Authors:	Flores-Solis, D, Rodriguez De La Vega, R, del Rio-Portilla, F.
Deposit date:	2016-05-13
Release date:	2016-06-29
Last modified:	2020-01-15
Method:	SOLUTION NMR
Cite:	Solution structure and antiparasitic activity of scorpine-like peptides from Hoffmannihadrurus gertschi. Febs Lett., 590, 2016

7PTH

C54S mutant of choline-sulfatase from E. meliloti CECT4857 bound to choline
Descriptor:	1,2-ETHANEDIOL, ACETATE ION, CALCIUM ION, ...
Authors:	Gavira, J.A, Martinez-Rodriguez, S.
Deposit date:	2021-09-27
Release date:	2022-08-03
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (1.85 Å)
Cite:	Structural insights into choline-O-sulfatase reveal the molecular determinants for ligand binding. Acta Crystallogr D Struct Biol, 78, 2022

7PTJ

C54S mutant of choline-sulfatase from E. meliloti CECT4857 bound to HEPES
Descriptor:	4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CALCIUM ION, Choline sulfatase, ...
Authors:	Gavira, J.A, Martinez-Rodriguez, S.
Deposit date:	2021-09-27
Release date:	2022-08-03
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (2.1 Å)
Cite:	Structural insights into choline-O-sulfatase reveal the molecular determinants for ligand binding. Acta Crystallogr D Struct Biol, 78, 2022

8BRA

Polyester Hydrolase Leipzig 7 (PHL7) bound to terephthalic acid (TPA) and Mg2+
Descriptor:	MAGNESIUM ION, Polyester Hydrolase Leipzig 7 (PHL-7), catalysis-deficient S131A mutant, ...
Authors:	Richter, P.K, Strater, N.
Deposit date:	2022-11-22
Release date:	2023-04-19
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Structure and function of the metagenomic plastic-degrading polyester hydrolase PHL7 bound to its product. Nat Commun, 14, 2023

8BRB

Polyester Hydrolase Leipzig 7 (PHL7) bound to terephthalic acid (TPA)
Descriptor:	DIMETHYL SULFOXIDE, Polyester Hydrolase Leipzig 7 (PHL-7), catalysis-deficient S131A mutant, ...
Authors:	Richter, P.K, Strater, N.
Deposit date:	2022-11-22
Release date:	2023-04-19
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Structure and function of the metagenomic plastic-degrading polyester hydrolase PHL7 bound to its product. Nat Commun, 14, 2023

7SBD

Murine Fab/IgE in complex with profilin from Hevea brasieliensis (Hev b 8)
Descriptor:	Fab/IgE Heavy chain, Fab/IgE Light chain, Profilin-2, ...
Authors:	Rodriguez-Romero, A, Garcia-Ramirez, B.
Deposit date:	2021-09-24
Release date:	2022-08-10
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (3.04 Å)
Cite:	A native IgE in complex with profilin provides insights into allergen recognition and cross-reactivity. Commun Biol, 5, 2022

7SBG

Murine Fab/IgE in complex with profilin from Hevea brasieliensis (Hev b 8)
Descriptor:	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Fab/IgE Heavy chain, Fab/IgE Light chain, ...
Authors:	Rodriguez-Romero, A, Garcia-Ramirez, B.
Deposit date:	2021-09-24
Release date:	2022-08-10
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (3.34 Å)
Cite:	A native IgE in complex with profilin provides insights into allergen recognition and cross-reactivity. Commun Biol, 5, 2022

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