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8ROV
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BU of 8rov by Molmil
Human dectin-2 with dimerization domain
Descriptor: C-type lectin domain family 6 member A, CALCIUM ION, SODIUM ION, ...
Authors:Liu, Y, Kim, J.W, Feinberg, H, Cull, N, Weis, W.I, Taylor, M.E, Drickamer, K.
Deposit date:2024-01-12
Release date:2024-10-16
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (2.36 Å)
Cite:Interactions that define the arrangement of sugar-binding sites in BDCA-2 and dectin-2 dimers.
Glycobiology, 34, 2024
6H4G
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BU of 6h4g by Molmil
Regulatory subunit of a cAMP-independent protein kinase A from Trypanosoma brucei: E311A, T318R, V319A mutant bound to cAMP in the A site
Descriptor: ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE, INOSINE, Protein kinase A regulatory subunit
Authors:Volpato Santos, Y, Lorentzen, E, Basquin, J, Boshart, M.
Deposit date:2018-07-21
Release date:2019-08-14
Last modified:2024-04-10
Method:X-RAY DIFFRACTION (2.143517 Å)
Cite:Purine nucleosides replace cAMP in allosteric regulation of PKA in trypanosomatid pathogens.
Elife, 12, 2024
5L9J
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BU of 5l9j by Molmil
Room temperature X-ray diffraction of tetragonal HEWL. First data set (0.31 MGy)
Descriptor: ACETATE ION, CHLORIDE ION, Lysozyme C
Authors:Castellvi, A, Juanhuix, J.
Deposit date:2016-06-10
Release date:2016-06-22
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Uridine as a new scavenger for synchrotron-based structural biology techniques.
J Synchrotron Radiat, 24, 2017
6H54
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BU of 6h54 by Molmil
CRYSTAL STRUCTURE OF BOVINE HSC70(AA1-554)E213A/D214A IN COMPLEX WITH INHIBITOR VER155008
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 4-[[(2R,3S,4R,5R)-5-[6-amino-8-[(3,4-dichlorophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-oxolan-2-yl]methoxymethyl]benzonitrile, GLYCEROL, ...
Authors:Plank, C, Zehe, M, Grimm, C, Sotriffer, C.
Deposit date:2018-07-23
Release date:2019-08-14
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:Combined In-Solution Fragment Screening and Crystallographic Binding-Mode Analysis with a Two-Domain Hsp70 Construct.
Acs Chem.Biol., 2024
7BDZ
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BU of 7bdz by Molmil
X-ray structure of Hen Egg White Lysozyme with dirhodium tetraacetate (1)
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Lysozyme, ...
Authors:Loreto, D, Merlino, A, Ferraro, G.
Deposit date:2020-12-22
Release date:2021-02-24
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Unusual Structural Features in the Adduct of Dirhodium Tetraacetate with Lysozyme.
Int J Mol Sci, 22, 2021
7BE0
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BU of 7be0 by Molmil
X-ray structure of Hen Egg White Lysozyme with dirhodium tetraacetate (2)
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Lysozyme, ...
Authors:Loreto, D, Merlino, A, Ferraro, G.
Deposit date:2020-12-22
Release date:2021-02-24
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Unusual Structural Features in the Adduct of Dirhodium Tetraacetate with Lysozyme.
Int J Mol Sci, 22, 2021
7BEC
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BU of 7bec by Molmil
Unusual structural features in the adduct of dirhodium tetraacetate with lysozyme (5)
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Lysozyme, ...
Authors:Loreto, D, Ferraro, G, Merlino, A.
Deposit date:2020-12-23
Release date:2021-02-24
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Unusual Structural Features in the Adduct of Dirhodium Tetraacetate with Lysozyme.
Int J Mol Sci, 22, 2021
7BEB
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BU of 7beb by Molmil
Unusual structural features in the adduct of dirhodium tetraacetate with lysozyme (4)
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Lysozyme, ...
Authors:Loreto, D, Ferraro, G, Merlino, A.
Deposit date:2020-12-23
Release date:2021-02-24
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.32 Å)
Cite:Unusual Structural Features in the Adduct of Dirhodium Tetraacetate with Lysozyme.
Int J Mol Sci, 22, 2021
5KSI
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BU of 5ksi by Molmil
Crystal structure of deoxygenated hemoglobin in complex with sphingosine phosphate and 2,3-Bisphosphoglycerate
Descriptor: (2R)-2,3-diphosphoglyceric acid, (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate, Hemoglobin subunit alpha, ...
Authors:Ahmed, M.H, Safo, M.K, Xia, Y.
Deposit date:2016-07-08
Release date:2017-07-26
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural and Functional Insight of Sphingosine 1-Phosphate-Mediated Pathogenic Metabolic Reprogramming in Sickle Cell Disease.
Sci Rep, 7, 2017
7BE2
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BU of 7be2 by Molmil
X-ray structure of Hen Egg White Lysozyme with dirhodium tetraacetate (6)
Descriptor: ACETATE ION, GLYCEROL, Lysozyme, ...
Authors:Loreto, D, Merlino, A, Ferraro, G.
Deposit date:2020-12-22
Release date:2021-02-24
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Unusual Structural Features in the Adduct of Dirhodium Tetraacetate with Lysozyme.
Int J Mol Sci, 22, 2021
7BE1
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BU of 7be1 by Molmil
X-ray structure of Hen Egg White Lysozyme with dirhodium tetraacetate (3)
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Lysozyme, ...
Authors:Loreto, D, Merlino, A, Ferraro, G.
Deposit date:2020-12-22
Release date:2021-02-24
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Unusual Structural Features in the Adduct of Dirhodium Tetraacetate with Lysozyme.
Int J Mol Sci, 22, 2021
5KWQ
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BU of 5kwq by Molmil
Two Tandem RRM Domains of FBP-Interacting Repressor (FIR), also Known as PUF60
Descriptor: Poly(U)-binding-splicing factor PUF60
Authors:Crichlow, G.V, Yang, Y, Zhou, H, Lolis, E.J, Braddock, D.T.
Deposit date:2016-07-18
Release date:2017-08-23
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Unraveling the mechanism of recognition of the 3' splice site of the adenovirus major late promoter intron by the alternative splicing factor PUF60.
Plos One, 15, 2020
7B9L
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BU of 7b9l by Molmil
MEK1 in complex with compound 23
Descriptor: Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, GLYCEROL, MAGNESIUM ION, ...
Authors:Kack, H, Oster, L.
Deposit date:2020-12-14
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Fragment-Based Discovery of Novel Allosteric MEK1 Binders.
Acs Med.Chem.Lett., 12, 2021
5KTI
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BU of 5kti by Molmil
Structure of cow mincle complexed with KMJ1
Descriptor: 2,3-dimethoxybenzoic acid, CALCIUM ION, TRIETHYLENE GLYCOL, ...
Authors:Feinberg, H, Rambaruth, N.D.S, Jegouzo, S.A.F, Jacobsen, K.M, Djurhuus, R, Poulsen, T.B, Taylor, M.E, Drickamer, K, Weis, W.I.
Deposit date:2016-07-11
Release date:2016-08-31
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Binding Sites for Acylated Trehalose Analogs of Glycolipid Ligands on an Extended Carbohydrate Recognition Domain of the Macrophage Receptor Mincle.
J.Biol.Chem., 291, 2016
5HAV
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BU of 5hav by Molmil
Sperm whale myoglobin mutant L29H F33Y F43H (F33Y CuBMb) with oxygen bound
Descriptor: Myoglobin, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE
Authors:Petrik, I.D, Lu, Y.
Deposit date:2015-12-31
Release date:2016-01-13
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.268 Å)
Cite:Spectroscopic and Crystallographic Evidence for the Role of a Water-Containing H-Bond Network in Oxidase Activity of an Engineered Myoglobin.
J.Am.Chem.Soc., 138, 2016
5KXX
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BU of 5kxx by Molmil
Hen Egg White Lysozyme at 278K, Data set 7
Descriptor: Lysozyme C, SODIUM ION
Authors:Russi, S, Gonzalez, A, Kenner, L.R, Keedy, D.A, Fraser, J.S, van den Bedem, H.
Deposit date:2016-07-20
Release date:2016-09-07
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Conformational variation of proteins at room temperature is not dominated by radiation damage.
J Synchrotron Radiat, 24, 2017
7BDO
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BU of 7bdo by Molmil
MAPK14 bound with SR302
Descriptor: Mitogen-activated protein kinase 14, ~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-[[(3~{S})-1-methylsulfonylpiperidin-3-yl]amino]-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
Authors:Schroeder, M, Roehm, S, Joerger, A, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2020-12-22
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Development of a Selective Dual Discoidin Domain Receptor (DDR)/p38 Kinase Chemical Probe.
J.Med.Chem., 64, 2021
5H9A
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BU of 5h9a by Molmil
Crystal structure of the Apo form of human cellular retinol binding protein 1
Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Retinol-binding protein 1
Authors:Golczak, M, Arne, J.M, Silvaroli, J.A, Kiser, P.D, Banerjee, S.
Deposit date:2015-12-26
Release date:2016-03-02
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.381 Å)
Cite:Ligand Binding Induces Conformational Changes in Human Cellular Retinol-binding Protein 1 (CRBP1) Revealed by Atomic Resolution Crystal Structures.
J.Biol.Chem., 291, 2016
7BE4
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BU of 7be4 by Molmil
Crystal structure of MAP kinase p38 alpha in complex with inhibitor SR159
Descriptor: 5-azanyl-~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-[[(3~{R})-1-methylsulfonylpiperidin-3-yl]amino]-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide, Mitogen-activated protein kinase 14
Authors:Joerger, A.C, Schroeder, M, Roehm, S, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2020-12-22
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Development of a Selective Dual Discoidin Domain Receptor (DDR)/p38 Kinase Chemical Probe.
J.Med.Chem., 64, 2021
7BDQ
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BU of 7bdq by Molmil
MAPK14 bound with SR300
Descriptor: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Mitogen-activated protein kinase 14, ...
Authors:Schroeder, M, Roehm, S, Joerger, A, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2020-12-22
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.75 Å)
Cite:Development of a Selective Dual Discoidin Domain Receptor (DDR)/p38 Kinase Chemical Probe.
J.Med.Chem., 64, 2021
8RLH
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BU of 8rlh by Molmil
Neutron structure of hydrogenated hen egg-white lysozyme at room temperature
Descriptor: ACETATE ION, Lysozyme C, NITRATE ION
Authors:Ramos, J, Laux, V, Mason, S.A, Lemee, M, Bowler, M, Diederichs, K, Haertlein, M, Forsyth, V.T, Mossou, E, Larsen, S, Langkilde, A.E.
Deposit date:2024-01-03
Release date:2024-11-06
Method:NEUTRON DIFFRACTION (1.1 Å)
Cite:Neutron structure of hydrogenated hen egg-white lysozyme at room temperature
To Be Published
8RLI
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BU of 8rli by Molmil
Neutron structure of perdeuterated hen egg-white lysozyme at room temperature
Descriptor: ACETATE ION, Lysozyme C, NITRATE ION
Authors:Ramos, J, Laux, V, Mason, S.A, Lemee, M, Bowler, M, Diederichs, K, Haertlein, M, Forsyth, V.T, Mossou, E, Larsen, S, Langkilde, A.E.
Deposit date:2024-01-03
Release date:2024-11-06
Method:NEUTRON DIFFRACTION (0.91 Å)
Cite:Neutron structure of perdeuterated hen egg-white lysozyme at room temperature
To Be Published
5KXL
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BU of 5kxl by Molmil
Hen Egg White Lysozyme at 100K, Data set 2
Descriptor: ACETATE ION, CHLORIDE ION, Lysozyme C, ...
Authors:Russi, S, Gonzalez, A, Kenner, L.R, Keedy, D.A, Fraser, J.S, van den Bedem, H.
Deposit date:2016-07-20
Release date:2016-09-07
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.198 Å)
Cite:Conformational variation of proteins at room temperature is not dominated by radiation damage.
J Synchrotron Radiat, 24, 2017
7B94
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BU of 7b94 by Molmil
MEK1 in complex with compound 6
Descriptor: 2-(4-iodophenyl)-8~{H}-imidazo[1,2-c]pyrimidin-5-one, Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
Authors:Kack, H, Oster, L.
Deposit date:2020-12-14
Release date:2021-03-03
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2 Å)
Cite:Fragment-Based Discovery of Novel Allosteric MEK1 Binders.
Acs Med.Chem.Lett., 12, 2021
5KXS
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BU of 5kxs by Molmil
Hen Egg White Lysozyme at 278K, Data set 4
Descriptor: Lysozyme C, SODIUM ION
Authors:Russi, S, Gonzalez, A, Kenner, L.R, Keedy, D.A, Fraser, J.S, van den Bedem, H.
Deposit date:2016-07-20
Release date:2016-09-07
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Conformational variation of proteins at room temperature is not dominated by radiation damage.
J Synchrotron Radiat, 24, 2017

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