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7ZB1
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BU of 7zb1 by Molmil
S580A with 18mer
Descriptor: 1,2-ETHANEDIOL, 18mer, BICARBONATE ION, ...
Authors:Song, H, Naismith, J.H.
Deposit date:2022-03-23
Release date:2022-07-06
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2 Å)
Cite:Molecular basis for the enzymatic macrocyclization of multiply backbone N-methylated peptides
Biorxiv, 2022
7ZB0
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BU of 7zb0 by Molmil
macrocyclase OphP with 15mer
Descriptor: 1,2-ETHANEDIOL, 15mer, BICARBONATE ION, ...
Authors:Song, H, Naismith, J.H.
Deposit date:2022-03-23
Release date:2022-07-06
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.47 Å)
Cite:Molecular basis for the enzymatic macrocyclization of multiply backbone N-methylated peptides
Biorxiv, 2022
6SJ4
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BU of 6sj4 by Molmil
Amidohydrolase, AHS with substrate analog
Descriptor: 1,2-ETHANEDIOL, 3-(3-hydroxyphenyl)carbonyloxybenzoic acid, Amidohydrolase, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
7BSC
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BU of 7bsc by Molmil
Complex structure of 1G5.3 Fab bound to DENV2 NS1c
Descriptor: 1G5.3 Fab Heavy Chain, 1G5.3 Fab Light Chain, Non-structural protein 1
Authors:Song, H, Qi, J, Gao, F.G.
Deposit date:2020-03-30
Release date:2020-12-23
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:A broadly protective antibody that targets the flavivirus NS1 protein.
Science, 371, 2021
5N0O
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BU of 5n0o by Molmil
Crystal structure of Seleno-OphA-DeltaC18 in complex with SAM
Descriptor: 1,2-ETHANEDIOL, L-HOMOSERINE, Peptide N-methyltransferase, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2017-02-03
Release date:2018-02-14
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:A molecular mechanism for the enzymatic methylation of nitrogen atoms within peptide bonds.
Sci Adv, 4, 2018
5N0Q
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BU of 5n0q by Molmil
Crystal structure of OphA-DeltaC6 in complex with SAH
Descriptor: Peptide N-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
Authors:Naismith, J.H, Song, H.
Deposit date:2017-02-03
Release date:2018-02-14
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.402 Å)
Cite:A molecular mechanism for the enzymatic methylation of nitrogen atoms within peptide bonds.
Sci Adv, 4, 2018
5N0P
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BU of 5n0p by Molmil
Crystal structure of OphA-DeltaC18 in complex with SAH
Descriptor: 1,2-ETHANEDIOL, S-ADENOSYL-L-HOMOCYSTEINE, peptide N-methyltranferase
Authors:Naismith, J.H, Song, H.
Deposit date:2017-02-03
Release date:2018-02-14
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:A molecular mechanism for the enzymatic methylation of nitrogen atoms within peptide bonds.
Sci Adv, 4, 2018
7BSD
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BU of 7bsd by Molmil
Complex structure of 1G5.3 Fab bound to ZIKV NS1c
Descriptor: 1G5.3 Fab Heavy Chain, 1G5.3 Fab Light Chain, NS1C
Authors:Song, H, Qi, J, Gao, F.G.
Deposit date:2020-03-30
Release date:2020-12-23
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.53 Å)
Cite:A broadly protective antibody that targets the flavivirus NS1 protein.
Science, 371, 2021
6SIY
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BU of 6siy by Molmil
PaaK family AMP-ligase with AMP and substrate
Descriptor: 1,2-ETHANEDIOL, 3-HYDROXYANTHRANILIC ACID, ADENOSINE MONOPHOSPHATE, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SJ0
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BU of 6sj0 by Molmil
Amidohydrolase, AHS
Descriptor: Amidohydrolase, BICARBONATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SIX
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BU of 6six by Molmil
PaaK family AMP-ligase with ANP
Descriptor: 1,2-ETHANEDIOL, AMP-dependent synthetase and ligase, CITRATE ANION, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SIZ
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BU of 6siz by Molmil
PaaK family AMP-ligase with ANP and substrate
Descriptor: 1,2-ETHANEDIOL, 3-HYDROXYANTHRANILIC ACID, AMP-dependent synthetase and ligase, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SJ3
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BU of 6sj3 by Molmil
Amidohydrolase, AHS with 3-HBA
Descriptor: 1,2-ETHANEDIOL, 3-HYDROXYBENZOIC ACID, Amidohydrolase, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.17 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SJ1
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BU of 6sj1 by Molmil
Amidohydrolase, AHS
Descriptor: Amidohydrolase, ZINC ION
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SIW
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BU of 6siw by Molmil
PaaK family AMP-ligase with AMP
Descriptor: 1,2-ETHANEDIOL, 2-(2-(2-(2-(2-(2-ETHOXYETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHANOL, ADENOSINE MONOPHOSPHATE, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6TM4
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BU of 6tm4 by Molmil
NatL2 in complex with two molecules of salicylic acid
Descriptor: 2-HYDROXYBENZOIC ACID, ADENOSINE MONOPHOSPHATE, MAGNESIUM ION, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-12-03
Release date:2020-01-15
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
6SJ2
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BU of 6sj2 by Molmil
Amidohydrolase, AHS with 3-HAA
Descriptor: 3-HYDROXYANTHRANILIC ACID, Amidohydrolase, GLYCEROL, ...
Authors:Naismith, J.H, Song, H.
Deposit date:2019-08-12
Release date:2020-01-15
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:The Biosynthesis of the Benzoxazole in Nataxazole Proceeds via an Unstable Ester and has Synthetic Utility.
Angew.Chem.Int.Ed.Engl., 59, 2020
7NEF
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BU of 7nef by Molmil
Fucosylated linear peptide Fln65 bound to the fucose binding lectin LecB PA-IIL from Pseudomonas aeruginosa at 1.5 Angstrom resolution
Descriptor: 3,7-anhydro-2,8-dideoxy-L-glycero-D-gluco-octonic acid, CALCIUM ION, Fln65, ...
Authors:Personne, H, Baeriswyl, S, Stocker, A, Reymond, J.-L.
Deposit date:2021-02-03
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:A mixed chirality alpha-helix in a stapled bicyclic and a linear antimicrobial peptide revealed by X-ray crystallography.
Rsc Chem Biol, 2, 2021
7NEW
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BU of 7new by Molmil
Fucosylated heterochiral linear peptide Fdln69 bound to the fucose binding lectin LecB PA-IIL from Pseudomonas aeruginosa at 2.0 Angstrom resolution
Descriptor: 3,7-anhydro-2,8-dideoxy-L-glycero-D-gluco-octonic acid, CALCIUM ION, Fucose-binding lectin, ...
Authors:Personne, H, Baeriswyl, S, Stocker, A, Reymond, J.-L.
Deposit date:2021-02-05
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:A mixed chirality alpha-helix in a stapled bicyclic and a linear antimicrobial peptide revealed by X-ray crystallography.
Rsc Chem Biol, 2, 2021
6K7O
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BU of 6k7o by Molmil
Complex structure of LILRB4 and h128-3 antibody
Descriptor: Leukocyte immunoglobulin-like receptor subfamily B member 4, h128-3 Fab heavy chain, h128-3 Fab light chain
Authors:Song, H, Chai, Y, Xu, X, Gao, F.G.
Deposit date:2019-06-08
Release date:2019-07-03
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.004 Å)
Cite:Disrupting LILRB4/APOE Interaction by an Efficacious Humanized Antibody Reverses T-cell Suppression and Blocks AML Development.
Cancer Immunol Res, 7, 2019
5VAG
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BU of 5vag by Molmil
Crystal structure of H7-specific antibody m826 in complex with the HA1 domain of hemagglutinin from H7N9 influenza virus
Descriptor: 1,2-ETHANEDIOL, Heavy chain of antibody m826, Hemagglutinin, ...
Authors:Song, H, Ying, T, Ji, X.
Deposit date:2017-03-26
Release date:2017-12-20
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A Potent Germline-like Human Monoclonal Antibody Targets a pH-Sensitive Epitope on H7N9 Influenza Hemagglutinin.
Cell Host Microbe, 22, 2017
5D6M
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BU of 5d6m by Molmil
Mn(II)-loaded MnCcP.1
Descriptor: Cytochrome c peroxidase, mitochondrial, MANGANESE (II) ION, ...
Authors:Robinson, H, Gao, Y.-G, Hosseinzadeh, P, Lu, Y.
Deposit date:2015-08-12
Release date:2016-03-09
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.653 Å)
Cite:Enhancing Mn(II)-Binding and Manganese Peroxidase Activity in a Designed Cytochrome c Peroxidase through Fine-Tuning Secondary-Sphere Interactions.
Biochemistry, 55, 2016
3NJ2
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BU of 3nj2 by Molmil
Crystal structure of cce_0566 from the cyanobacterium Cyanothece 51142, a protein associated with nitrogen fixation from the DUF269 family
Descriptor: DUF269-containing protein
Authors:Robinson, H, Ralston, C.Y, Addlagatta, A, Buchko, G.W.
Deposit date:2010-06-16
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:Crystal structure of cce_0566 from Cyanothece 51142, a protein associated with nitrogen fixation in the DUF269 family.
Febs Lett., 586, 2012
3PJW
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BU of 3pjw by Molmil
Structure of Pseudomonas fluorescence LapD GGDEF-EAL dual domain, I23
Descriptor: Cyclic dimeric GMP binding protein
Authors:Sondermann, H, Navarro, M.V.A.S.
Deposit date:2010-11-10
Release date:2011-02-09
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (3.1006 Å)
Cite:Structural Basis for c-di-GMP-Mediated Inside-Out Signaling Controlling Periplasmic Proteolysis.
Plos Biol., 9, 2011
3PJV
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BU of 3pjv by Molmil
Structure of Pseudomonas fluorescence LapD periplasmic domain
Descriptor: Cyclic dimeric GMP binding protein
Authors:Sondermann, H, Navarro, M.V.A.S, Chatterjee, D.
Deposit date:2010-11-10
Release date:2011-02-09
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.7727 Å)
Cite:Structural Basis for c-di-GMP-Mediated Inside-Out Signaling Controlling Periplasmic Proteolysis.
Plos Biol., 9, 2011

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