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6P25
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STRUCTURE OF S. CEREVISIAE PROTEIN O-MANNOSYLTRANSFERASE PMT1-PMT2 COMPLEX BOUND TO THE SUGAR DONOR AND A PEPTIDE ACCEPTOR
Descriptor:Dolichyl-phosphate-mannose--protein mannosyltransferase 1, Dolichyl-phosphate-mannose--protein mannosyltransferase 2, acceptor peptide, ...
Authors:Bai, L., Li, H.
Deposit date:2019-05-21
Release date:2019-07-10
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structure of the eukaryotic protein O-mannosyltransferase Pmt1-Pmt2 complex
Nat.Struct.Mol.Biol., 2019
6P28
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CRYSTAL STRUCTURE OF THE MIR DOMAIN (AA 337-532) OF THE S. CEREVISIAE MANNOSYLTRANSFERASE PMT2
Descriptor:Dolichyl-phosphate-mannose--protein mannosyltransferase 2
Authors:Bai, L., Li, H.
Deposit date:2019-05-21
Release date:2019-07-10
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Structure of the eukaryotic protein O-mannosyltransferase Pmt1-Pmt2 complex
Nat.Struct.Mol.Biol., 2019
6P2R
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STRUCTURE OF S. CEREVISIAE PROTEIN O-MANNOSYLTRANSFERASE PMT1-PMT2 COMPLEX BOUND TO THE SUGAR DONOR
Descriptor:Dolichyl-phosphate-mannose--protein mannosyltransferase 1, Dolichyl-phosphate-mannose--protein mannosyltransferase 2, N-ACETYL-D-GLUCOSAMINE, ...
Authors:Bai, L., Li, H.
Deposit date:2019-05-21
Release date:2019-07-10
Method:ELECTRON MICROSCOPY (3.2 Å)
Cite:Structure of the eukaryotic protein O-mannosyltransferase Pmt1-Pmt2 complex
Nat.Struct.Mol.Biol., 2019
6IO4
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SILVER-BOUND GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASE A
Descriptor:Glyceraldehyde-3-phosphate dehydrogenase A, SILVER ION
Authors:Wang, H., Sun, H., Wang, M.
Deposit date:2018-10-29
Release date:2019-07-03
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Antimicrobial silver targets glyceraldehyde-3-phosphate dehydrogenase in glycolysis of E. coli
Chem Sci, 2019
6IO6
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SILVER-BOUND GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASE A AT NON-CATALYTIC SITE
Descriptor:Glyceraldehyde-3-phosphate dehydrogenase A, SILVER ION
Authors:Wang, H., Sun, H., Wang, M.
Deposit date:2018-10-29
Release date:2019-07-03
Method:X-RAY DIFFRACTION (2.64 Å)
Cite:Antimicrobial silver targets glyceraldehyde-3-phosphate dehydrogenase in glycolysis of E. coli
Chem Sci, 2019
6IOJ
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GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASE A (APO-FORM)
Descriptor:Glyceraldehyde-3-phosphate dehydrogenase A
Authors:Wang, H., Sun, H., Wang, M.
Deposit date:2018-10-30
Release date:2019-07-03
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Antimicrobial silver targets glyceraldehyde-3-phosphate dehydrogenase in glycolysis of E. coli
Chem Sci, 2019
6P3P
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CRYSTAL STRUCTURE OF MCL-1 IN COMPLEX WITH COMPOUND 65
Descriptor:Induced myeloid leukemia cell differentiation protein Mcl-1, methyl N-(5-{[2-chloro-5-(trifluoromethyl)phenyl]sulfamoyl}-4-methylthiophene-2-carbonyl)-D-phenylalaninate
Authors:Toms, A.V., Follows, B.
Deposit date:2019-05-24
Release date:2019-07-03
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Discovery of novel biaryl sulfonamide based Mcl-1 inhibitors.
Bioorg.Med.Chem.Lett., 2019
6JCN
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YEAST DEHYDRODOLICHYL DIPHOSPHATE SYNTHASE COMPLEX SUBUNIT NUS1
Descriptor:Dehydrodolichyl diphosphate synthase complex subunit NUS1, SULFATE ION
Authors:Ko, T.-P., Ma, J., Liu, W., Chen, C.-C., Guo, R.-T.
Deposit date:2019-01-29
Release date:2019-06-19
Last modified:2019-07-10
Method:X-RAY DIFFRACTION (1.998 Å)
Cite:Structural insights to heterodimeric cis-prenyltransferases through yeast dehydrodolichyl diphosphate synthase subunit Nus1.
Biochem.Biophys.Res.Commun., 515, 2019
6BS3
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CRYSTAL STRUCTURE OF ADP-BOUND BACTERIAL GET3-LIKE A AND B IN MYCOBACTERIUM TUBERCULOSIS
Descriptor:Putative ATPase Rv3679, Anion transporter, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Li, H., Hu, K., Kovach, A.
Deposit date:2017-12-01
Release date:2019-05-15
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Mycobacterial Get3-like proteins: biochemical and structural characterization
To Be Published
6BS4
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CRYSTAL STRUCTURE OF ATPGAMMAS-BOUND BACTERIAL GET3-LIKE A AND B IN MYCOBACTERIUM TUBERCULOSIS
Descriptor:Putative ATPase Rv3679, Anion transporter, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, ...
Authors:Li, H., Hu, K., Kovach, A.
Deposit date:2017-12-01
Release date:2019-05-15
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Mycobacterial Get3-like proteins: biochemical and structural characterization
To Be Published
6BS5
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CRYSTAL STRUCTURE OF AMP-PNP-BOUND BACTERIAL GET3-LIKE A AND B IN MYCOBACTERIUM TUBERCULOSIS
Descriptor:Putative ATPase Rv3679, Anion transporter, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
Authors:Li, H., Hu, K., Kovach, A.
Deposit date:2017-12-01
Release date:2019-05-15
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Mycobacterial Get3-like proteins: biochemical and structural characterization
To Be Published
6IG9
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TRA1 SUBUNIT FROM SACCHAROMYCES CEREVISIAE SAGA COMPLEX
Descriptor:Transcription-associated protein 1
Authors:Zheng, X.D., Liu, G.C., Guan, H.P., Li, H.T.
Deposit date:2018-09-25
Release date:2019-05-15
Last modified:2019-05-22
Method:ELECTRON MICROSCOPY (4.6 Å)
Cite:Architecture ofSaccharomyces cerevisiaeSAGA complex.
Cell Discov, 5, 2019
6J3O
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CRYSTAL STRUCTURE OF THE HUMAN PCAF BROMODOMAIN IN COMPLEX WITH COMPOUND 12
Descriptor:Histone acetyltransferase KAT2B, 3-methyl-2-[[(3~{R})-1-methylpiperidin-3-yl]amino]-5~{H}-pyrrolo[3,2-d]pyrimidin-4-one
Authors:Huang, L.Y., Li, H., Li, L.L., Niu, L., Seupel, R., Wu, C.Y., Li, G.B., Yu, Y.M., Brennan, P.E., Yang, S.Y.
Deposit date:2019-01-05
Release date:2019-05-01
Last modified:2019-05-22
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Discovery of Pyrrolo[3,2- d]pyrimidin-4-one Derivatives as a New Class of Potent and Cell-Active Inhibitors of P300/CBP-Associated Factor Bromodomain.
J.Med.Chem., 62, 2019
6J3P
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CRYSTAL STRUCTURE OF THE HUMAN GCN5 BROMODOMAIN IN COMPLEX WITH COMPOUND (R,R)-36N
Descriptor:Histone acetyltransferase KAT2A, 2-{[(3R,5R)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylpiperidin-3-yl]amino}-3-methyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Authors:Huang, L.Y., Li, H., Niu, L., Wu, C.Y., Yu, Y.M., Li, L.L., Yang, S.Y.
Deposit date:2019-01-05
Release date:2019-05-01
Last modified:2019-05-22
Method:X-RAY DIFFRACTION (1.598 Å)
Cite:Discovery of Pyrrolo[3,2- d]pyrimidin-4-one Derivatives as a New Class of Potent and Cell-Active Inhibitors of P300/CBP-Associated Factor Bromodomain.
J.Med.Chem., 62, 2019
5ZGC
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CRYSTAL STRUCTURE OF SIRT3 IN COMPLEX WITH H4K16BHB PEPTIDE
Descriptor:NAD-dependent protein deacetylase sirtuin-3, mitochondrial, Histone H4K16bhb peptide, ...
Authors:Li, H., Zhang, X.
Deposit date:2018-03-08
Release date:2019-04-03
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Crystal Structure of SIRT3 in complex with H4K16bhb peptide
To be published
5ZJW
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CRYSTAL STRUCTURE OF PAK4 IN COMPLEX WITH INHIBITOR CZG353
Descriptor:Serine/threonine-protein kinase PAK 4, (3Z)-N-[(1S)-2-hydroxy-1-phenylethyl]-3-[(1H-imidazol-2-yl)(phenyl)methylidene]-2-oxo-2,3-dihydro-1H-indole-5-carboxamide, 1,2-ETHANEDIOL, ...
Authors:Zhao, F., Li, H.
Deposit date:2018-03-22
Release date:2019-04-03
Method:X-RAY DIFFRACTION (1.798 Å)
Cite:Crystal Structure of PAK4 in complex with inhibitor CZg353
To be published
5ZID
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CRYSTAL STRUCTURE OF HUMAN DPP-IV IN COMPLEX WITH HL2
Descriptor:Dipeptidyl peptidase 4, N-ACETYL-D-GLUCOSAMINE, (2S,3R)-2-amino-9-methoxy-3-(2,4,5-trifluorophenyl)-2,3-dihydro-1H-naphtho[2,1-b]pyran-8-carbonitrile, ...
Authors:Zhu, L., Li, H., Wu, F.
Deposit date:2018-03-14
Release date:2019-03-20
Last modified:2019-04-17
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystal Structure of human DPP-IV in complex with HL2
To Be Published
6J69
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STRUCTURE OF KIBRA AND DENDRIN COMPLEX
Descriptor:Protein KIBRA, Peptide from Dendrin
Authors:Lin, Z., Yang, Z., Ji, Z., Zhang, M.
Deposit date:2019-01-14
Release date:2019-03-20
Method:X-RAY DIFFRACTION (2.753 Å)
Cite:Kibra Modulates Learning and Memory via Binding to Dendrin.
Cell Rep, 26, 2019
6NG1
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH 6-(3-FLUORO-5-(3-(METHYLAMINO)PROP-1-YN-1-YL)PHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019
6NG2
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH 6-(3-(3-(DIMETHYLAMINO)PROP-1-YN-1-YL)-5-FLUOROPHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019
6NG4
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH (R)-6-(3-FLUORO-5-(2-(PYRROLIDIN-2-YL)ETHYL)PHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (1.776 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019
6NG5
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH (R)-6-(3-FLUORO-5-(2-(1-METHYLPYRROLIDIN-2-YL)ETHYL)PHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (1.96 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019
6NG6
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH (S)-6-(3-FLUORO-5-(2-(PYRROLIDIN-2-YL)ETHYL)PHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (2.044 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019
6NG7
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH 6-(3-FLUORO-5-(2-((2R,4S)-4-FLUORO-1-METHYLPYRROLIDIN-2-YL)ETHYL)PHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (2 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019
6NG8
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STRUCTURE OF HUMAN NEURONAL NITRIC OXIDE SYNTHASE R354A/G357D MUTANT HEME DOMAIN IN COMPLEX WITH 6-(5-(3-(DIMETHYLAMINO)PROPYL)-2,3-DIFLUOROPHENETHYL)-4-METHYLPYRIDIN-2-AMINE
Descriptor:Nitric oxide synthase, brain, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Li, H., Poulos, T.L.
Deposit date:2018-12-21
Release date:2019-03-13
Last modified:2019-03-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Optimization of Blood-Brain Barrier Permeability with Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibitors Having a 2-Aminopyridine Scaffold.
J. Med. Chem., 62, 2019