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6RP3
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BU of 6rp3 by Molmil
Truncated Norcoclaurine synthase with reaction intermediate mimic
Descriptor: 1,2-ETHANEDIOL, 4-[2-[[(2~{R})-2-phenylpropyl]amino]ethyl]benzene-1,2-diol, S-norcoclaurine synthase
Authors:Keep, N.H, Roddan, R, Sula, A.
Deposit date:2019-05-13
Release date:2019-10-09
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Acceptance and Kinetic Resolution of alpha-Methyl-Substituted Aldehydes by Norcoclaurine Synthases
Acs Catalysis, 2019
5L90
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BU of 5l90 by Molmil
The crystal structure of substrate-free CYP109E1 from Bacillus megaterium at 2.55 Angstrom resolution
Descriptor: Cytochrome P450, PROTOPORPHYRIN IX CONTAINING FE
Authors:Jozwik, I.K, Thunnissen, A.M.W.H.
Deposit date:2016-06-09
Release date:2016-10-05
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Structural basis of steroid binding and oxidation by the cytochrome P450 CYP109E1 from Bacillus megaterium.
Febs J., 283, 2016
6TOE
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BU of 6toe by Molmil
Imine Reductase from Myxococcus stipitatus V8 variant in complex with NAD+
Descriptor: Coenzyme F420-dependent NADP oxidoreductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Sharma, M, Nestl, B, Grogan, G.
Deposit date:2019-12-11
Release date:2020-12-09
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.78 Å)
Cite:Inverting the Stereoselectivity of an NADH-Dependent Imine-Reductase Variant
Chemcatchem, 2021
6TO4
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BU of 6to4 by Molmil
Imine Reductase from Myxococcus stipitatus in complex with NADP+
Descriptor: Coenzyme F420-dependent NADP oxidoreductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Sharma, M, Nestl, B, Grogan, G.
Deposit date:2019-12-11
Release date:2020-12-09
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Inverting the Stereoselectivity of an NADH-Dependent Imine-Reductase Variant
Chemcatchem, 2021
8AHB
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BU of 8ahb by Molmil
rsEGFP2 photoswitched to its off-state at room temperature and back-switched to its on-state at 100K
Descriptor: Green fluorescent protein, SULFATE ION
Authors:Mantovanelli, A, Adam, V.
Deposit date:2022-07-21
Release date:2023-07-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Photophysical Studies at Cryogenic Temperature Reveal a Novel Photoswitching Mechanism of rsEGFP2.
J.Am.Chem.Soc., 145, 2023
8AHA
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BU of 8aha by Molmil
rsEGFP2 photoswitched to its off-state at 100K
Descriptor: Green fluorescent protein, SULFATE ION
Authors:Mantovanelli, A, Adam, V.
Deposit date:2022-07-21
Release date:2023-07-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.38 Å)
Cite:Photophysical Studies at Cryogenic Temperature Reveal a Novel Photoswitching Mechanism of rsEGFP2.
J.Am.Chem.Soc., 145, 2023
3N7X
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BU of 3n7x by Molmil
Crystal structure of Penaeus stylirostris densovirus capsid
Descriptor: CALCIUM ION, Capsid protein, MAGNESIUM ION
Authors:Kaufmann, B, Rossmann, M.G.
Deposit date:2010-05-27
Release date:2010-11-17
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure of Penaeus stylirostris densovirus, a shrimp pathogen.
J.Virol., 84, 2010
4C4K
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BU of 4c4k by Molmil
Crystal structure of the titin M10-Obscurin Ig domain 1 complex
Descriptor: 1,2-ETHANEDIOL, OBSCURIN, TITIN
Authors:Pernigo, S, Fukuzawa, A, Gautel, M, Steiner, R.A.
Deposit date:2013-09-05
Release date:2014-09-24
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The Crystal Structure of the Human Titin:Obscurin Complex Reveals a Conserved Yet Specific Muscle M-Band Zipper Module.
J.Mol.Biol., 427, 2015
7B5W
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BU of 7b5w by Molmil
RCK_C domain of S.agalactiae BusR in ligand-free state
Descriptor: GntR family transcriptional regulator
Authors:Bandera, A.M, Witte, G.
Deposit date:2020-12-07
Release date:2021-08-11
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1 Å)
Cite:BusR senses bipartite DNA binding motifs by a unique molecular ruler architecture.
Nucleic Acids Res., 49, 2021
2OGZ
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BU of 2ogz by Molmil
Crystal structure of DPP-IV complexed with Lilly aryl ketone inhibitor
Descriptor: 4-[(3R)-3-{[2-(4-FLUOROPHENYL)-2-OXOETHYL]AMINO}BUTYL]BENZAMIDE, Dipeptidyl peptidase
Authors:Timm, D.E.
Deposit date:2007-01-09
Release date:2007-03-06
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Discovery of non-covalent dipeptidyl peptidase IV inhibitors which induce a conformational change in the active site.
Bioorg.Med.Chem.Lett., 17, 2007
7B5U
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BU of 7b5u by Molmil
RCK_C domain dimer of S.agalactiae BusR in complex with c-di-AMP
Descriptor: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, GntR family transcriptional regulator
Authors:Bandera, A.M, Witte, G.
Deposit date:2020-12-07
Release date:2021-08-11
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:BusR senses bipartite DNA binding motifs by a unique molecular ruler architecture.
Nucleic Acids Res., 49, 2021
7B5Y
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BU of 7b5y by Molmil
S. agalactiae BusR in complex with its busAB-promotor DNA
Descriptor: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, BusR binding site in the busAB promotor. strand1, BusR binding site in the busAB promotor. strand2, ...
Authors:Bandera, A.M, Witte, G.
Deposit date:2020-12-07
Release date:2021-08-11
Last modified:2024-07-10
Method:ELECTRON MICROSCOPY (7.1 Å)
Cite:BusR senses bipartite DNA binding motifs by a unique molecular ruler architecture.
Nucleic Acids Res., 49, 2021
7B5T
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BU of 7b5t by Molmil
S. agalactiae BusR transcription factor
Descriptor: GntR family transcriptional regulator
Authors:Bandera, A.M, Witte, G.
Deposit date:2020-12-07
Release date:2021-08-11
Last modified:2021-10-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:BusR senses bipartite DNA binding motifs by a unique molecular ruler architecture.
Nucleic Acids Res., 49, 2021
2LC0
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BU of 2lc0 by Molmil
Rv0020c_Nter structure
Descriptor: Putative uncharacterized protein TB39.8
Authors:Barthe, P.P, Cohen-Gonsaud, M.M, Roumestand, C.
Deposit date:2011-04-11
Release date:2011-11-02
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Structural Insight into the Mycobacterium tuberculosis Rv0020c Protein and Its Interaction with the PknB Kinase
Structure, 19, 2011
2LC1
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BU of 2lc1 by Molmil
Rv0020c_FHA Structure
Descriptor: Putative uncharacterized protein TB39.8
Authors:Barthe, P.P, Cohen-Gonsaud, M.M, Roumestand, C.C.
Deposit date:2011-04-11
Release date:2011-11-02
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Structural Insight into the Mycobacterium tuberculosis Rv0020c Protein and Its Interaction with the PknB Kinase
Structure, 19, 2011
7Z28
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BU of 7z28 by Molmil
High-resolution crystal structure of ERAP1 with bound bestatin analogue inhibitor
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Giastas, P, Papakyriakou, A, Stratikos, E, Vourloumis, D.
Deposit date:2022-02-26
Release date:2022-07-27
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Discovery of Selective Nanomolar Inhibitors for Insulin-Regulated Aminopeptidase Based on alpha-Hydroxy-beta-amino Acid Derivatives of Bestatin.
J.Med.Chem., 65, 2022
5NZZ
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BU of 5nzz by Molmil
Crystal structure of phosphorylated p38aMAPK in complex with TAB1
Descriptor: MAGNESIUM ION, Mitogen-activated protein kinase 14, NICKEL (II) ION, ...
Authors:Nichols, C.E, De Nicola, G.F.
Deposit date:2017-05-15
Release date:2018-05-30
Last modified:2018-09-19
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:The TAB1-p38 alpha complex aggravates myocardial injury and can be targeted by small molecules.
JCI Insight, 3, 2018
5OCM
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BU of 5ocm by Molmil
Imine Reductase from Streptosporangium roseum in complex with NADP+ and 2,2,2-trifluoroacetophenone hydrate
Descriptor: 2,2,2-trifluoromethyl acetophenone hydrate, MAGNESIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Sharma, M, Nestl, B, Grogan, G.
Deposit date:2017-07-03
Release date:2018-05-16
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:New imine-reducing enzymes from beta-hydroxyacid dehydrogenases by single amino acid substitutions.
Protein Eng. Des. Sel., 31, 2018

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