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6JZT
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STRUCTURE OF THE BACTERIAL FLAGELLAR HOOK FROM SALMONELLA TYPHIMURIUM
Descriptor:Flagellar hook protein FlgE
Authors:Saijo-Hamano, Y., Matsunami, H., Namba, K., Imada, K.
Deposit date:2019-05-03
Release date:2019-07-17
Method:ELECTRON MICROSCOPY (7.1 Å)
Cite:Architecture of the Bacterial Flagellar Distal Rod and Hook of Salmonella
Biomolecules, 9, 2019
6K1Q
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HUMAN ENDOTHELIN RECEPTOR TYPE-B IN COMPLEX WITH INVERSE AGONIST IRL2500
Descriptor:Endothelin B receptor,Endolysin,Endothelin B receptor, (2~{S})-2-[[(2~{R})-2-[(3,5-dimethylphenyl)carbonyl-methyl-amino]-3-(4-phenylphenyl)propanoyl]amino]-3-(1~{H}-indol-3-yl)propanoic acid, PHOSPHATE ION, ...
Authors:Nagiri, C., Shihoya, W., Nureki, O.
Deposit date:2019-05-11
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystal structure of human endothelin ETBreceptor in complex with peptide inverse agonist IRL2500.
Commun Biol, 2, 2019
6K5E
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CRYSTAL STRUCTURE OF BIOH FROM KLEBSIELLA PNEUMONIA
Descriptor:Pimeloyl-[acyl-carrier protein] methyl ester esterase
Authors:Wang, L., Chen, Y.
Deposit date:2019-05-28
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.257 Å)
Cite:Crystal structure of BioH from Klebsiella pneumonia
To Be Published
6K9U
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DISCOVERY OF PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVE AS A HIGHLY SELECTIVE PDE10A INHIBITOR
Descriptor:cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, ZINC ION, MAGNESIUM ION, ...
Authors:Takedomi, K., Koizumi, Y.
Deposit date:2019-06-18
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Discovery of a pyrazolo[1,5-a]pyrimidine derivative (MT-3014) as a highly selective PDE10A inhibitor via core structure transformation from the stilbene moiety.
Bioorg.Med.Chem., 2019
6KBR
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CRYSTAL STRUCTURE OF HUMAN KLK4 AND SPINK2 DERIVED KLK4 INHIBITOR COMPLEX
Descriptor:Kallikrein-4, K41043, GLYCEROL
Authors:Kawaguchi, Y., Nishimiya, D.
Deposit date:2019-06-26
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2 Å)
Cite:A protein scaffold, engineered SPINK2, for generation of inhibitors with high affinity and specificity against target proteases
To Be Published
6KCZ
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SOLUTION STRUCTURE OF THE ZNF-UBP DOMAIN OF USP20/VDU2
Descriptor:Ubiquitin carboxyl-terminal hydrolase 20, ZINC ION
Authors:Yang, Y., Wen, Y., Zhang, N.
Deposit date:2019-06-30
Release date:2019-07-17
Method:SOLUTION NMR
Cite:Solution structure of the ZnF-UBP domain of USP20/VDU2
To Be Published
6KD1
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ROOM TEMPERATURE STRUCTURE OF LYSOZYME DELIVERED IN AGAROSE BY SERIAL MILLISECOND CRYSTALLOGRAPHY
Descriptor:Lysozyme C, SODIUM ION, CHLORIDE ION
Authors:Nam, K.H.
Deposit date:2019-06-30
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Room temperature structure of lysozyme delivered in agarose by serial millisecond crystallography
To Be Published
6KD2
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ROOM TEMPERATURE STRUCTURE OF GLUCOSE ISOMERASE DELIVERED IN GELATIN BY SERIAL MILLISECOND CRYSTALLOGRAPHY
Descriptor:Xylose isomerase, MAGNESIUM ION
Authors:Nam, K.H.
Deposit date:2019-06-30
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Room temperature structure of glucose isomerase delivered in gelatin by serial millisecond crystallography
To Be Published
6MAC
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TERNARY STRUCTURE OF GDF11 BOUND TO ACTRIIB-ECD AND ALK5-ECD
Descriptor:Growth/differentiation factor 11, Activin receptor type-2B, TGF-beta receptor type-1, ...
Authors:Goebel, E.J., Thompson, T.B.
Deposit date:2018-08-27
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:Structural characterization of an activin class ternary receptor complex reveals a third paradigm for receptor specificity
Proc.Natl.Acad.Sci.USA, 2019
6MLX
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CRYSTAL STRUCTURE OF T. PALLIDUM LEUCINE RICH REPEAT PROTEIN (TPLRR)
Descriptor:Leucine-rich repeat protein TpLRR
Authors:Ramaswamy, R., Loveless, B.C., Houston, S., Cameron, C.E., Boulanger, M.J.
Deposit date:2018-09-28
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural characterization of Treponema pallidum Tp0225 reveals an unexpected leucine-rich repeat architecture
Acta Crystallogr.,Sect.F, 2019
6MO4
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CO-CRYSTAL STRUCTURE OF P. AERUGINOSA LPXC-50067 COMPLEX
Descriptor:UDP-3-O-acyl-N-acetylglucosamine deacetylase, MAGNESIUM ION, N-[(2R)-1-(hydroxyamino)-3-methyl-3-(methylsulfonyl)-1-oxobutan-2-yl]-4-(6-hydroxyhexa-1,3-diyn-1-yl)benzamide
Authors:Stein, A.J., Assar, Z., Holt, M.C., Cohen, F., Andrews, L., Cirz, R.
Deposit date:2018-10-04
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.844 Å)
Cite:Optimization of LpxC Inhibitors for Antibacterial Activity and Cardiovascular Safety.
Chemmedchem, 2019
6MO5
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CO-CRYSTAL STRUCTURE OF P. AERUGINOSA LPXC-50228 COMPLEX
Descriptor:UDP-3-O-acyl-N-acetylglucosamine deacetylase, N-[(2S)-1-(hydroxyamino)-3-methyl-3-{[(oxetan-3-yl)methyl]sulfonyl}-1-oxobutan-2-yl]-4-(6-hydroxyhexa-1,3-diyn-1-yl)benzamide, MAGNESIUM ION
Authors:Stein, A.J., Holt, M.C., Assar, Z., Cohen, F., Andrews, L., Cirz, R.
Deposit date:2018-10-04
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.851 Å)
Cite:Optimization of LpxC Inhibitors for Antibacterial Activity and Cardiovascular Safety.
Chemmedchem, 2019
6MOD
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CO-CRYSTAL STRUCTURE OF P. AERUGINOSA LPXC-50432 COMPLEX
Descriptor:UDP-3-O-acyl-N-acetylglucosamine deacetylase, MAGNESIUM ION, N-[(1S)-2-(hydroxyamino)-1-(3-methoxy-1,1-dioxo-1lambda~6~-thietan-3-yl)-2-oxoethyl]-4-(6-hydroxyhexa-1,3-diyn-1-yl)benzamide, ...
Authors:Stein, A.J., Holt, M.C., Assar, Z., Cohen, F., Andrews, L., Cirz, R.
Deposit date:2018-10-04
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Optimization of LpxC Inhibitors for Antibacterial Activity and Cardiovascular Safety.
Chemmedchem, 2019
6MOO
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CO-CRYSTAL STRUCTURE OF P. AERUGINOSA LPXC-ACHN975 COMPLEX
Descriptor:UDP-3-O-acyl-N-acetylglucosamine deacetylase, ZINC ION, N-[(2S)-3-azanyl-3-methyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-4-[4-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]buta-1,3-diynyl]benzamide
Authors:Stein, A.J., Assar, Z., Holt, M.C., Cohen, F., Andrews, L., Cirz, R.
Deposit date:2018-10-04
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Optimization of LpxC Inhibitors for Antibacterial Activity and Cardiovascular Safety.
Chemmedchem, 2019
6MQ5
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STRUCTURE OF HUMAN CLASP1 TOG1
Descriptor:CLIP-associating protein 1
Authors:Leano, J.B., Slep, K.C.
Deposit date:2018-10-09
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.146 Å)
Cite:Crystal structure of CLASP1 TOG1 domain
To Be Published
6MQ7
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CRYSTAL STRUCTURE OF CLASP1 TOG2 DOMAIN AT 1.78A RESOLUTION
Descriptor:CLIP-associating protein 1
Authors:Leano, J.B., Slep, K.C.
Deposit date:2018-10-09
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Structures of TOG1 and TOG2 From the Human Microtubule Dynamics Regulator CLASP1
To Be Published
6MV1
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2.15A RESOLUTION STRUCTURE OF THE CS-B5R DOMAINS OF HUMAN NCB5OR (NAD+ FORM)
Descriptor:Cytochrome b5 reductase 4, FLAVIN-ADENINE DINUCLEOTIDE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Lovell, S., Mehzabeen, N., Battaile, K.P., Benson, D.R., Cooper, A., Gao, P., Zhu, H.
Deposit date:2018-10-24
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Crystal structures of the naturally fused CS and cytochrome b5 reductase (b5R) domains of Ncb5or reveal an expanded CS fold, extensive CS-5R interactions and productive binding of the NAD(P)+ nicotinamide ring
Acta Crystallogr.,Sect.D, 2019
6MV2
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2.05A RESOLUTION STRUCTURE OF THE CS-B5R DOMAINS OF HUMAN NCB5OR (NADP+ FORM)
Descriptor:Cytochrome b5 reductase 4, FLAVIN-ADENINE DINUCLEOTIDE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Lovell, S., Mehzabeen, N., Battaile, K.P., Benson, D.R., Cooper, A., Gao, P., Zhu, H.
Deposit date:2018-10-24
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Crystal structures of the naturally fused CS and cytochrome b5 reductase (b5R) domains of Ncb5or reveal an expanded CS fold, extensive CS-5R interactions and productive binding of the NAD(P)+ nicotinamide ring
Acta Crystallogr.,Sect.D, 2019
6N0X
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CRYSTAL STRUCTURE OF ANAEROLINEA THERMOPHILA MEVALONATE 5-PHOSPHATE DECARBOXYLASE COMPLEXED WITH (R)-MVAP
Descriptor:Diphosphomevalonate decarboxylase, (3R)-3-HYDROXY-3-METHYL-5-(PHOSPHONOOXY)PENTANOIC ACID
Authors:Noel, J.P., Thomas, S.T., Louie, G.V.
Deposit date:2018-11-07
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:Substrate specificity and engineering of mevalonate 5-phosphate decarboxylase.
Acs Chem.Biol., 2019
6N0Y
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CRYSTAL STRUCTURE OF ANAEROLINEA THERMOPHILA MEVALONATE 5-PHOSPHATE DECARBOXYLASE COMPLEXED WITH (R)-MVAPP
Descriptor:Diphosphomevalonate decarboxylase, (3R)-3-HYDROXY-5-{[(R)-HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}-3-METHYLPENTANOIC ACID
Authors:Noel, J.P., Thomas, S.T., Louie, G.V.
Deposit date:2018-11-07
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Substrate specificity and engineering of mevalonate 5-phosphate decarboxylase.
Acs Chem.Biol., 2019
6N0Z
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CRYSTAL STRUCTURE OF ANAEROLINEA THERMOPHILA MEVALONATE 5-PHOSPHATE DECARBOXYLASE N20K H194M MUTANT COMPLEXED WITH (R)-MVAPP
Descriptor:Diphosphomevalonate decarboxylase, (3R)-3-HYDROXY-5-{[(R)-HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}-3-METHYLPENTANOIC ACID
Authors:Noel, J.P., Thomas, S.T., Louie, G.V.
Deposit date:2018-11-07
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Substrate specificity and engineering of mevalonate 5-phosphate decarboxylase.
Acs Chem.Biol., 2019
6N10
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CRYSTAL STRUCTURE OF ARABIDOPSIS THALIANA MEVALONATE 5-DIPHOSPHATE DECARBOXYLASE 1 COMPLEXED WITH (R)-MVAPP
Descriptor:Diphosphomevalonate decarboxylase MVD1, peroxisomal, (3R)-3-HYDROXY-5-{[(R)-HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}-3-METHYLPENTANOIC ACID, ...
Authors:Noel, J.P., Thomas, S.T., Louie, G.V.
Deposit date:2018-11-07
Release date:2019-07-17
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Substrate specificity and engineering of mevalonate 5-phosphate decarboxylase.
Acs Chem.Biol., 2019
6N2M
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NMR SOLUTION STRUCTURE OF THE HOMODIMERIC, AUTOINHIBITED STATE OF THE CARD9 CARD AND FIRST COILED-COIL
Descriptor:Caspase recruitment domain-containing protein 9, ZINC ION
Authors:Holliday, M.J., Fairbrother, W.J., Dueber, E.C.
Deposit date:2018-11-13
Release date:2019-07-17
Method:SOLUTION NMR
Cite:Structures of autoinhibited and polymerized forms of CARD9 reveal mechanisms of CARD9 and CARD11 activation
Nat Commun, 2019
6N5M
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CRYSTAL STRUCTURE OF ABIN-1 UBAN IN COMPLEX WITH ONE M1-LINKED DI-UBIQUITIN
Descriptor:Polyubiquitin-C, TNFAIP3-interacting protein 1
Authors:Rahighi, S., Dikic, I., Wakatsuki, S.
Deposit date:2018-11-22
Release date:2019-07-17
Method:X-RAY DIFFRACTION (3.01 Å)
Cite:Molecular Recognition of M1-Linked Ubiquitin Chains by Native and Phosphorylated UBAN Domains.
J.Mol.Biol., 2019
6N63
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CRYSTAL STRUCTURE OF AN IRON BINDING PROTEIN
Descriptor:ENCAPSULIN CARGO PROTEIN, GLYCOLIC ACID, ACETATE ION, ...
Authors:Birrane, G., Geissen, T.W.
Deposit date:2018-11-24
Release date:2019-07-17
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Large protein organelles form a new iron sequestration system with high storage capacity.
Elife, 8, 2019