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6YQC
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BU of 6yqc by Molmil
Taka-amylase in complex with alpha-glucosyl epi-cyclophellitol epoxide inhibitor
Descriptor: (1~{R},2~{S},4~{R},5~{S},6~{R})-6-[(2~{S},3~{R},4~{R},5~{S},6~{R})-5-heptoxy-6-(hydroxymethyl)-3,4-bis(oxidanyl)oxan-2-yl]oxy-5-(hydroxymethyl)cyclohexane-1,2,4-triol, 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Armstrong, Z, Chen, Y, Artola, M, Overkleeft, H, Davies, G.
Deposit date:2020-04-16
Release date:2021-02-10
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Activity-Based Protein Profiling of Retaining alpha-Amylases in Complex Biological Samples.
J.Am.Chem.Soc., 143, 2021
6YQB
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BU of 6yqb by Molmil
Taka-amylase in complex with alpha-glucosyl epi-cyclophellitol cyclosulfate inhibitor
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, Alpha-amylase, ...
Authors:Armstrong, Z, Chen, Y, Artola, M, Overkleeft, H, Davies, G.
Deposit date:2020-04-16
Release date:2021-02-10
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Activity-Based Protein Profiling of Retaining alpha-Amylases in Complex Biological Samples.
J.Am.Chem.Soc., 143, 2021
6YQA
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BU of 6yqa by Molmil
Taka-amylase in complex with alpha-glucosyl epi-cyclophellitol aziridine inhibitor
Descriptor: (1~{S},2~{R},3~{R},4~{R},5~{R})-5-(8-azanyloctylamino)-4-(hydroxymethyl)cyclohexane-1,2,3-triol, 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Armstrong, Z, Chen, Y, Artola, M, Overkleeft, H, Davies, G.
Deposit date:2020-04-16
Release date:2021-02-24
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Activity-Based Protein Profiling of Retaining alpha-Amylases in Complex Biological Samples.
J.Am.Chem.Soc., 143, 2021
6JHY
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BU of 6jhy by Molmil
Crystal Structure of the S1 subunit N-terminal domain from DcCoV UAE-HKU23 spike protein
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike protein
Authors:Lu, G, Cheng, Y, Ye, F.
Deposit date:2019-02-19
Release date:2019-07-24
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of the S1 subunit N-terminal domain from DcCoV UAE-HKU23 spike protein.
Virology, 535, 2019
8CZZ
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BU of 8czz by Molmil
Cryo-EM structure of T/F100 SOSIP.664 HIV-1 Env trimer with LMHS mutations in complex with Temsavir, 8ANC195, and 10-1074
Descriptor: 1-[4-(benzenecarbonyl)piperazin-1-yl]-2-[4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]ethane-1,2-dione, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Chen, Y, Pozharski, E, Tolbert, W, Pazgier, M.
Deposit date:2022-05-25
Release date:2023-05-31
Last modified:2023-11-08
Method:ELECTRON MICROSCOPY (3.14 Å)
Cite:Structure-function analyses reveal key molecular determinants of HIV-1 CRF01_AE resistance to the entry inhibitor temsavir.
Nat Commun, 14, 2023
8KGO
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BU of 8kgo by Molmil
Structure of African swine fever virus topoisomerase II in complex with dsDNA
Descriptor: DNA topoisomerase 2
Authors:Chen, Y, Xin, Y, Li, X, Cong, J.
Deposit date:2023-08-19
Release date:2024-04-03
Method:ELECTRON MICROSCOPY (3.4 Å)
Cite:Structure of African swine fever virus topoisomerase II in complex with dsDNA
To Be Published
2L3N
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BU of 2l3n by Molmil
Solution structure of Rap1-Taz1 fusion protein
Descriptor: DNA-binding protein rap1,Telomere length regulator taz1
Authors:Zhou, Z.R, Wang, F, Chen, Y, Lei, M, Hu, H.
Deposit date:2010-09-19
Release date:2011-01-12
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:A conserved motif within RAP1 has diversified roles in telomere protection and regulation in different organisms.
Nat.Struct.Mol.Biol., 18, 2011
7RBY
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BU of 7rby by Molmil
Crystal structure of Nanobody nb112 and SARS-CoV-2 RBD
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Ilama-isolated nanobody NIH-CoV nb-112 specific to SARS-CoV-2 RBD, MAGNESIUM ION, ...
Authors:Chen, Y, Tolbert, W, Pazgier, M.
Deposit date:2021-07-06
Release date:2022-03-23
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.82 Å)
Cite:Nebulized delivery of a broadly neutralizing SARS-CoV-2 RBD-specific nanobody prevents clinical, virological, and pathological disease in a Syrian hamster model of COVID-19.
Mabs, 14
7RQ6
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BU of 7rq6 by Molmil
Cryo-EM structure of SARS-CoV-2 spike in complex with non-neutralizing NTD-directed CV3-13 Fab isolated from convalescent individual
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CV3-13 Fab heavy chain, ...
Authors:Chen, Y, Pozharski, E, Tolbert, W.D, Pazgier, M.
Deposit date:2021-08-05
Release date:2022-04-20
Last modified:2023-08-09
Method:ELECTRON MICROSCOPY (4.18 Å)
Cite:A Fc-enhanced NTD-binding non-neutralizing antibody delays virus spread and synergizes with a nAb to protect mice from lethal SARS-CoV-2 infection.
Cell Rep, 38, 2022
3P2T
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BU of 3p2t by Molmil
Crystal Structure of Leukocyte Ig-like Receptor LILRB4 (ILT3/LIR-5/CD85k)
Descriptor: Leukocyte immunoglobulin-like receptor subfamily B member 4, SULFATE ION
Authors:Chen, Y, Nam, G, Cheng, H, Zhang, J.H, Willcox, B.E, Gao, G.F.
Deposit date:2010-10-04
Release date:2011-03-30
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.699 Å)
Cite:Crystal structure of leukocyte Ig-like receptor LILRB4 (ILT3/LIR-5/CD85k): a myeloid inhibitory receptor involved in immune tolerance
J.Biol.Chem., 286, 2011
6UEG
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BU of 6ueg by Molmil
Pseudomonas aeruginosa LpxA Complex Structure with Ligand
Descriptor: 3-({2-[(2R)-2-carbamoyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-2-oxoethyl}sulfanyl)propanoic acid, Acyl-[acyl-carrier-protein]--UDP-N-acetylglucosamine O-acyltransferase, CALCIUM ION
Authors:Chen, Y, Kroeck, K, Sacco, M.
Deposit date:2019-09-20
Release date:2019-11-13
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Discovery of dual-activity small-molecule ligands of Pseudomonas aeruginosa LpxA and LpxD using SPR and X-ray crystallography.
Sci Rep, 9, 2019
6UEC
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BU of 6uec by Molmil
Pseudomonas aeruginosa LpxD Complex Structure with Ligand
Descriptor: 4-(naphthalen-1-yl)-4-oxobutanoic acid, DIMETHYL SULFOXIDE, MAGNESIUM ION, ...
Authors:Chen, Y, Kroeck, K, Sacco, M.
Deposit date:2019-09-20
Release date:2019-11-13
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Discovery of dual-activity small-molecule ligands of Pseudomonas aeruginosa LpxA and LpxD using SPR and X-ray crystallography.
Sci Rep, 9, 2019
6UEE
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BU of 6uee by Molmil
Pseudomonas aeruginosa LpxA Complex Structure with Ligand
Descriptor: 4-(naphthalen-1-yl)-4-oxobutanoic acid, Acyl-[acyl-carrier-protein]--UDP-N-acetylglucosamine O-acyltransferase, GLYCEROL
Authors:Chen, Y, Kroeck, K, Sacco, M.
Deposit date:2019-09-20
Release date:2019-11-13
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Discovery of dual-activity small-molecule ligands of Pseudomonas aeruginosa LpxA and LpxD using SPR and X-ray crystallography.
Sci Rep, 9, 2019
7YOT
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BU of 7yot by Molmil
Cryo-EM structure of RNA polymerase in complex with P protein tetramer of Newcastle disease virus
Descriptor: NDV P protein, RNA-directed RNA polymerase L
Authors:Chen, Y, Jingyuan, C.
Deposit date:2022-08-02
Release date:2023-02-15
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Structure of the Newcastle Disease Virus L protein in complex with tetrameric phosphoprotein.
Nat Commun, 14, 2023
7YOU
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BU of 7you by Molmil
Cryo-EM structure of RNA polymerase in complex with P protein tetramer of Newcastle disease virus
Descriptor: NDV P protein, RNA-directed RNA polymerase L
Authors:Chen, Y, Jingyuan, C, Xiaoying, F.
Deposit date:2022-08-02
Release date:2023-02-15
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.41 Å)
Cite:Structure of the Newcastle Disease Virus L protein in complex with tetrameric phosphoprotein.
Nat Commun, 14, 2023
7YOV
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BU of 7yov by Molmil
Cryo-EM structure of RNA polymerase in complex with P protein tetramer of Newcastle disease virus
Descriptor: NDV P protein, RNA-directed RNA polymerase L
Authors:Chen, Y, Jingyuan, C, Xiaoying, F.
Deposit date:2022-08-02
Release date:2023-02-15
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.25 Å)
Cite:Structure of the Newcastle Disease Virus L protein in complex with tetrameric phosphoprotein.
Nat Commun, 14, 2023
6UED
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BU of 6ued by Molmil
Apo Pseudomonas aeruginosa LpxD Structure
Descriptor: GLYCEROL, MAGNESIUM ION, UDP-3-O-acylglucosamine N-acyltransferase
Authors:Chen, Y, Kroeck, K, Sacco, M.
Deposit date:2019-09-20
Release date:2019-11-13
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Discovery of dual-activity small-molecule ligands of Pseudomonas aeruginosa LpxA and LpxD using SPR and X-ray crystallography.
Sci Rep, 9, 2019
2IKQ
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BU of 2ikq by Molmil
Crystal structure of mouse Sts-1 PGM domain in complex with phosphate
Descriptor: PHOSPHATE ION, Suppressor of T-cell receptor signaling 1
Authors:Chen, Y, Nassar, N.
Deposit date:2006-10-02
Release date:2007-08-14
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.609 Å)
Cite:A Phosphatase Activity of Sts-1 Contributes to the Suppression of TCR Signaling
Mol.Cell, 27, 2007
2LS0
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BU of 2ls0 by Molmil
Solution Structure of the Target Recognition Domain of Zoocin A
Descriptor: Zoocin A endopeptidase
Authors:Timkovich, R, Chen, Y, Simmonds, R.S.
Deposit date:2012-04-17
Release date:2012-12-05
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of the recombinant target recognition domain of zoocin A.
Proteins, 81, 2013
3VAT
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BU of 3vat by Molmil
Crystal structure of DNPEP, ZnMg form
Descriptor: Aspartyl aminopeptidase, MAGNESIUM ION, ZINC ION
Authors:Kiser, P.D, Chen, Y, Palczewski, K.
Deposit date:2011-12-29
Release date:2012-02-29
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Insights into substrate specificity and metal activation of Mammalian tetrahedral aspartyl aminopeptidase.
J.Biol.Chem., 287, 2012
3VAR
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BU of 3var by Molmil
Crystal structure of DNPEP, ZnZn form
Descriptor: Aspartyl aminopeptidase, ZINC ION
Authors:Kiser, P.D, Chen, Y, Palczewski, K.
Deposit date:2011-12-29
Release date:2012-02-29
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Insights into substrate specificity and metal activation of Mammalian tetrahedral aspartyl aminopeptidase.
J.Biol.Chem., 287, 2012
8JBA
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BU of 8jba by Molmil
Discovery and Crystallography Study of Novel Oxadiazole Analogs as Small Molecule PD-1/PD-L1 inhibitors
Descriptor: (2~{S})-2-[[3-[[5-[(2-methyl-3-phenyl-phenoxy)methyl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]methylamino]-3-oxidanyl-propanoic acid, Programmed cell death 1 ligand 1
Authors:Cheng, Y, Xiao, Y.B.
Deposit date:2023-05-08
Release date:2023-10-25
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Discovery and Crystallography Study of Novel Biphenyl Ether and Oxadiazole Thioether (Non-Arylmethylamine)-Based Small-Molecule PD-1/PD-L1 Inhibitors as Immunotherapeutic Agents.
J.Med.Chem., 66, 2023
4IIK
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BU of 4iik by Molmil
Legionella pneumophila effector
Descriptor: Adenosine monophosphate-protein hydrolase SidD, CHLORIDE ION, GLYCEROL, ...
Authors:Tascon, I, Chen, Y, Neunuebel, M.R, Rojas, A.L, Machner, M.P, Hierro, A.
Deposit date:2012-12-20
Release date:2013-06-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural Basis for Rab1 De-AMPylation by the Legionella pneumophila Effector SidD
Plos Pathog., 9, 2013
4IIP
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BU of 4iip by Molmil
Legionella pneumophila effector
Descriptor: Adenosine monophosphate-protein hydrolase SidD, CHLORIDE ION, GLYCEROL
Authors:Tascon, I, Chen, Y, Neunuebel, M.R, Rojas, A.L, Machner, M.P, Hierro, A.
Deposit date:2012-12-20
Release date:2013-06-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural Basis for Rab1 De-AMPylation by the Legionella pneumophila Effector SidD
Plos Pathog., 9, 2013
2NYM
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BU of 2nym by Molmil
Crystal Structure of Protein Phosphatase 2A (PP2A) with C-terminus truncated catalytic subunit
Descriptor: MANGANESE (II) ION, Protein phosphatase 2, Serine/threonine-protein phosphatase 2A 56 kDa regulatory subunit gamma isoform, ...
Authors:Chen, Y, Xing, Y, Xu, Y, Chao, Y, Lin, Z, Jeffrey, P.D, Shi, Y.
Deposit date:2006-11-21
Release date:2006-12-12
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (3.6 Å)
Cite:Structure of the Protein Phosphatase 2A Holoenzyme.
Cell(Cambridge,Mass.), 127, 2006

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