4O2I
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![BU of 4o2i by Molmil](/molmil-images/mine/4o2i) | The crystal structure of non-LEE encoded type III effector C from Citrobacter rodentium | Descriptor: | Non-LEE encoded type III effector C, ZINC ION | Authors: | Chang, C, Xu, X, Cui, H, Savchenko, A, Adkins, J, Joachimiak, A, Midwest Center for Structural Genomics (MCSG), Program for the Characterization of Secreted Effector Proteins (PCSEP) | Deposit date: | 2013-12-17 | Release date: | 2014-01-15 | Last modified: | 2014-05-07 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | The crystal structure of non-LEE encoded type III effector C from Citrobacter rodentium To be Published
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4NO8
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![BU of 4no8 by Molmil](/molmil-images/mine/4no8) | yCP in complex with Z-Leu-Leu-Leu-ketoamide | Descriptor: | MAGNESIUM ION, N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2S,3S)-2-hydroxy-5-methyl-1-oxo-1-(phenylamino)hexan-3-yl]-L-leucinamide, Probable proteasome subunit alpha type-7, ... | Authors: | Stein, M.L, Cui, H, Beck, P, Dubiella, C, Voss, C, Krueger, A, Schmidt, B, Groll, M. | Deposit date: | 2013-11-19 | Release date: | 2014-02-12 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (2.7 Å) | Cite: | Systematic Comparison of Peptidic Proteasome Inhibitors Highlights the alpha-Ketoamide Electrophile as an Auspicious Reversible Lead Motif. Angew.Chem.Int.Ed.Engl., 53, 2014
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4O8O
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![BU of 4o8o by Molmil](/molmil-images/mine/4o8o) | Crystal structure of SthAraf62A, a GH62 family alpha-L-arabinofuranosidase from Streptomyces thermoviolaceus, bound to alpha-L-arabinose | Descriptor: | Alpha-L-arabinofuranosidase, CALCIUM ION, alpha-L-arabinofuranose | Authors: | Stogios, P.J, Wang, W, Xu, X, Cui, H, Master, E, Savchenko, A. | Deposit date: | 2013-12-28 | Release date: | 2014-07-02 | Last modified: | 2022-08-24 | Method: | X-RAY DIFFRACTION (1.21 Å) | Cite: | Elucidation of the molecular basis for arabinoxylan-debranching activity of a thermostable family GH62 alpha-l-arabinofuranosidase from Streptomyces thermoviolaceus. Appl.Environ.Microbiol., 80, 2014
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4NO1
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![BU of 4no1 by Molmil](/molmil-images/mine/4no1) | yCP in complex with Z-Leu-Leu-Leu-B(OH)2 | Descriptor: | MAGNESIUM ION, N-[(benzyloxy)carbonyl]-L-leucyl-N-[(1R)-1-(dihydroxyboranyl)-3-methylbutyl]-L-leucinamide, Probable proteasome subunit alpha type-7, ... | Authors: | Stein, M.L, Cui, H, Beck, P, Dubiella, C, Voss, C, Krueger, A, Schmidt, B, Groll, M. | Deposit date: | 2013-11-19 | Release date: | 2014-02-12 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (2.5 Å) | Cite: | Systematic Comparison of Peptidic Proteasome Inhibitors Highlights the alpha-Ketoamide Electrophile as an Auspicious Reversible Lead Motif. Angew.Chem.Int.Ed.Engl., 53, 2014
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3R1W
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![BU of 3r1w by Molmil](/molmil-images/mine/3r1w) | Crystal structure of a carbonic anhydrase from a crude oil degrading psychrophilic library | Descriptor: | carbonic anhydrase | Authors: | Petit, P, Xu, X, Cui, H, Brown, G, Dong, A, Savchenko, A, Yakunin, A.F. | Deposit date: | 2011-03-11 | Release date: | 2011-03-23 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.73 Å) | Cite: | Crystal structure of a carbonic anhydrase from a crude oil degrading psychrophilic library To be Published
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4PSU
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![BU of 4psu by Molmil](/molmil-images/mine/4psu) | Crystal structure of alpha/beta hydrolase from Rhodopseudomonas palustris CGA009 | Descriptor: | Alpha/beta hydrolase, DODECAETHYLENE GLYCOL | Authors: | Nocek, B, Hajighasemi, M, Xu, X, Cui, H, Savchenko, A, Yakunin, A. | Deposit date: | 2014-03-07 | Release date: | 2015-03-11 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Crystal structure of alpha/beta hydrolase from Rhodopseudomonas palustris CGA009 TO BE PUBLISHED
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4PV7
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![BU of 4pv7 by Molmil](/molmil-images/mine/4pv7) | Cocrystal structure of dipeptidyl-peptidase 4 with an indole scaffold inhibitor | Descriptor: | 1-[2-(2,4-dichlorophenyl)-1-(methylsulfonyl)-1H-indol-3-yl]methanamine, Dipeptidyl peptidase 4 soluble form | Authors: | Xiao, P, Guo, R, Huang, S, Cui, H, Ye, S, Zhang, Z. | Deposit date: | 2014-03-15 | Release date: | 2015-03-18 | Method: | X-RAY DIFFRACTION (3.24 Å) | Cite: | Discovery of dipeptidyl peptidase IV (DPP4) inhibitors based on a novel indole scaffold Chin.Chem.Lett., 25, 2014
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3R0P
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![BU of 3r0p by Molmil](/molmil-images/mine/3r0p) | Crystal structure of L-PSP putative endoribonuclease from uncultured organism | Descriptor: | L-PSP putative endoribonuclease | Authors: | Cuff, M.E, Petit, P, Xu, X, Cui, H, Savchenko, A, Yakunin, A.F. | Deposit date: | 2011-03-08 | Release date: | 2011-03-23 | Last modified: | 2024-02-21 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Crystal structure of L-PSP putative endoribonuclease from uncultured organism To be Published
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3PFC
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![BU of 3pfc by Molmil](/molmil-images/mine/3pfc) | Crystal structure of the Lactobacillus johnsonii cinnamoyl esterase LJ0536 S106A mutant in complex with ferulic acid | Descriptor: | 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, 3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID, CHLORIDE ION, ... | Authors: | Stogios, P.J, Lai, K.K, Vu, C, Xu, X, Cui, H, Molloy, S, Gonzalez, C.F, Yakunin, A, Savchenko, A. | Deposit date: | 2010-10-28 | Release date: | 2011-08-31 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (1.75 Å) | Cite: | An Inserted alpha/beta Subdomain Shapes the Catalytic Pocket of Lactobacillus johnsonii Cinnamoyl Esterase Plos One, 6, 2011
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3PF9
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![BU of 3pf9 by Molmil](/molmil-images/mine/3pf9) | Crystal structure of the Lactobacillus johnsonii cinnamoyl esterase LJ0536 S106A mutant | Descriptor: | Cinnamoyl esterase, SODIUM ION | Authors: | Stogios, P.J, Lai, K.K, Vu, C, Xu, X, Cui, H, Molloy, S, Gonzalez, C.F, Yakunin, A, Savchenko, A. | Deposit date: | 2010-10-28 | Release date: | 2011-08-31 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (1.75 Å) | Cite: | An Inserted alpha/beta Subdomain Shapes the Catalytic Pocket of Lactobacillus johnsonii Cinnamoyl Esterase Plos One, 6, 2011
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3PF8
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![BU of 3pf8 by Molmil](/molmil-images/mine/3pf8) | Crystal structure of the Lactobacillus johnsonii cinnamoyl esterase LJ0536 | Descriptor: | Cinnamoyl esterase, SODIUM ION | Authors: | Stogios, P.J, Lai, K.K, Vu, C, Xu, X, Cui, H, Molloy, S, Gonzalez, C.F, Yakunin, A, Savchenko, A. | Deposit date: | 2010-10-28 | Release date: | 2011-08-31 | Last modified: | 2023-09-06 | Method: | X-RAY DIFFRACTION (2.34 Å) | Cite: | An Inserted alpha/beta Subdomain Shapes the Catalytic Pocket of Lactobacillus johnsonii Cinnamoyl Esterase Plos One, 6, 2011
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3PFB
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![BU of 3pfb by Molmil](/molmil-images/mine/3pfb) | Crystal structure of the Lactobacillus johnsonii cinnamoyl esterase LJ0536 S106A mutant in complex with ethylferulate | Descriptor: | AMMONIUM ION, CHLORIDE ION, Cinnamoyl esterase, ... | Authors: | Stogios, P.J, Lai, K.K, Vu, C, Xu, X, Cui, H, Molloy, S, Gonzalez, C.F, Yakunin, A, Savchenko, A. | Deposit date: | 2010-10-28 | Release date: | 2011-08-31 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (1.58 Å) | Cite: | An Inserted alpha/beta Subdomain Shapes the Catalytic Pocket of Lactobacillus johnsonii Cinnamoyl Esterase Plos One, 6, 2011
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4PVI
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![BU of 4pvi by Molmil](/molmil-images/mine/4pvi) | Crystal structure of GH62 hydrolase in complex with xylotriose | Descriptor: | GH62 hydrolase, PHOSPHATE ION, beta-D-xylopyranose-(1-4)-beta-D-xylopyranose-(1-4)-beta-D-xylopyranose | Authors: | Nocek, B, Kaur, A.P, Xu, X, Cui, H, Savchenko, A. | Deposit date: | 2014-03-17 | Release date: | 2014-09-24 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.48 Å) | Cite: | Crystal structure of GH62 hydrolase in complex with xylotriose TO BE PUBLISHED
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3QUF
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![BU of 3quf by Molmil](/molmil-images/mine/3quf) | The structure of a family 1 extracellular solute-binding protein from Bifidobacterium longum subsp. infantis | Descriptor: | ACETIC ACID, Extracellular solute-binding protein, family 1, ... | Authors: | Cuff, M.E, Xu, X, Cui, H, Chin, S, Savchenko, A, Edwards, A, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2011-02-23 | Release date: | 2011-05-04 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.7 Å) | Cite: | The structure of a family 1 extracellular solute-binding protein from Bifidobacterium longum subsp. infantis TO BE PUBLISHED
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4QE7
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![BU of 4qe7 by Molmil](/molmil-images/mine/4qe7) | Open MthK pore structure soaked in 10 mM Ba2+/100 mM Na+ | Descriptor: | BARIUM ION, Calcium-gated potassium channel MthK | Authors: | Guo, R, Zeng, W, Cui, H, Chen, L, Ye, S. | Deposit date: | 2014-05-15 | Release date: | 2014-07-09 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | Ionic interactions of Ba2+ blockades in the MthK K+ channel J.Gen.Physiol., 144, 2014
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3QVO
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![BU of 3qvo by Molmil](/molmil-images/mine/3qvo) | Structure of a Rossmann-fold NAD(P)-binding family protein from Shigella flexneri. | Descriptor: | 5-MERCAPTO-2-NITRO-BENZOIC ACID, NmrA family protein | Authors: | Cuff, M.E, Xu, X, Cui, H, Edwards, A, Savchenko, A, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2011-02-25 | Release date: | 2011-06-01 | Last modified: | 2018-10-03 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Structure of a Rossmann-fold NAD(P)-binding family protein from Shigella flexneri. TO BE PUBLISHED
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3RAO
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![BU of 3rao by Molmil](/molmil-images/mine/3rao) | Crystal Structure of the Luciferase-like Monooxygenase from Bacillus cereus ATCC 10987. | Descriptor: | Putative Luciferase-like Monooxygenase, SULFATE ION | Authors: | Domagalski, M.J, Chruszcz, M, Xu, X, Cui, H, Chin, S, Savchenko, A, Edwards, A, Joachimiak, A, Minor, W, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2011-03-28 | Release date: | 2011-05-11 | Last modified: | 2022-04-13 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Crystal Structure of the Luciferase-like Monooxygenase from Bacillus cereus ATCC 10987. To be Published
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3OI7
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![BU of 3oi7 by Molmil](/molmil-images/mine/3oi7) | Structure of the structure of the H13A mutant of Ykr043C in complex with sedoheptulose-1,7-bisphosphate | Descriptor: | 1,2-ETHANEDIOL, 1,7-di-O-phosphono-beta-D-altro-hept-2-ulofuranose, GLYCEROL, ... | Authors: | Singer, A.U, Xu, X, Dong, A, Cui, H, Clasquin, M.F, Caudy, A.A, Edwards, A.M, Savchenko, A, Joachimiak, A, Yakunin, A.F, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2010-08-18 | Release date: | 2010-11-17 | Last modified: | 2023-12-06 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | Riboneogenesis in yeast. Cell(Cambridge,Mass.), 145, 2011
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3OMB
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![BU of 3omb by Molmil](/molmil-images/mine/3omb) | Crystal structure of extracellular solute-binding protein from Bifidobacterium longum subsp. infantis | Descriptor: | Extracellular solute-binding protein, family 1, MAGNESIUM ION | Authors: | Chang, C, Xu, X, Chin, S, Cui, H, Dong, A, Savchenko, A, Edwards, A, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2010-08-26 | Release date: | 2010-09-08 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (2.1 Å) | Cite: | Crystal structure of extracellular solute-binding protein from Bifidobacterium longum subsp. infantis To be Published
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3OMD
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![BU of 3omd by Molmil](/molmil-images/mine/3omd) | Crystal structure of unknown function protein from Leptospirillum rubarum | Descriptor: | Uncharacterized protein | Authors: | Chang, C, Xu, X, Cui, H, Chen, Z, Savchenko, A, Edwards, A, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2010-08-26 | Release date: | 2010-09-15 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.5 Å) | Cite: | Crystal structure of unknown function protein from Leptospirillum rubarum To be Published
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4NO9
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![BU of 4no9 by Molmil](/molmil-images/mine/4no9) | yCP in complex with Z-Leu-Leu-Leu-epoxyketone | Descriptor: | MAGNESIUM ION, N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethylheptan-4-yl]-L-leucinamide, N-[(benzyloxy)carbonyl]-L-leucyl-N-{(1R,2S)-1-hydroxy-4-methyl-1-[(2R)-2-methyloxiran-2-yl]pentan-2-yl}-L-leucinamide, ... | Authors: | Stein, M.L, Cui, H, Beck, P, Dubiella, C, Voss, C, Krueger, A, Schmidt, B, Groll, M. | Deposit date: | 2013-11-19 | Release date: | 2014-02-12 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (2.9 Å) | Cite: | Systematic Comparison of Peptidic Proteasome Inhibitors Highlights the alpha-Ketoamide Electrophile as an Auspicious Reversible Lead Motif. Angew.Chem.Int.Ed.Engl., 53, 2014
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3QM1
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![BU of 3qm1 by Molmil](/molmil-images/mine/3qm1) | CRYSTAL STRUCTURE OF THE LACTOBACILLUS JOHNSONII CINNAMOYL ESTERASE LJ0536 S106A MUTANT IN COMPLEX WITH ETHYLFERULATE, Form II | Descriptor: | CHLORIDE ION, Cinnamoyl esterase, SODIUM ION, ... | Authors: | Stogios, P.J, Lai, K.K, Vu, C, Xu, X, Cui, H, Molloy, S, Gonzalez, C.F, Yakunin, A, Savchenko, A. | Deposit date: | 2011-02-03 | Release date: | 2011-08-31 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.817 Å) | Cite: | An Inserted alpha/beta Subdomain Shapes the Catalytic Pocket of Lactobacillus johnsonii Cinnamoyl Esterase Plos One, 6, 2011
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3S40
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![BU of 3s40 by Molmil](/molmil-images/mine/3s40) | The crystal structure of a diacylglycerol kinases from Bacillus anthracis str. Sterne | Descriptor: | diacylglycerol kinase | Authors: | Tan, K, Zhang, R, Xu, X, Cui, H, Peterson, S, Savchenko, A, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) | Deposit date: | 2011-05-18 | Release date: | 2011-06-01 | Last modified: | 2023-12-06 | Method: | X-RAY DIFFRACTION (2.1 Å) | Cite: | The crystal structure of a diacylglycerol kinases from Bacillus anthracis str. Sterne To be Published
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3SVI
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![BU of 3svi by Molmil](/molmil-images/mine/3svi) | Structure of the Pto-binding domain of HopPmaL generated by limited thermolysin digestion | Descriptor: | CHLORIDE ION, SODIUM ION, SULFATE ION, ... | Authors: | Singer, A.U, Stein, A, Xu, X, Cui, H, Joachimiak, A, Edwards, A.M, Savchenko, A, Midwest Center for Structural Genomics (MCSG) | Deposit date: | 2011-07-12 | Release date: | 2011-08-10 | Last modified: | 2017-11-08 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structural Analysis of HopPmaL Reveals the Presence of a Second Adaptor Domain Common to the HopAB Family of Pseudomonas syringae Type III Effectors. Biochemistry, 51, 2012
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3S2Z
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![BU of 3s2z by Molmil](/molmil-images/mine/3s2z) | Crystal structure of the Lactobacillus johnsonii cinnamoyl esterase LJ0536 S106A mutant in complex with caffeic acid | Descriptor: | CAFFEIC ACID, CHLORIDE ION, Cinnamoyl esterase | Authors: | Stogios, P.J, Lai, K.K, Vu, C, Xu, X, Cui, H, Molloy, S, Gonzalez, C.F, Yakunin, A, Savchenko, A. | Deposit date: | 2011-05-17 | Release date: | 2011-08-31 | Last modified: | 2023-09-13 | Method: | X-RAY DIFFRACTION (1.76 Å) | Cite: | An inserted alpha/beta subdomain shapes the catalytic pocket of Lactobacillus johnsonii cinnamoyl esterase. Plos One, 6, 2011
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