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6SYP
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HUMAN DHODH BOUND TO INHIBITOR IPP/CNRS-A017
Descriptor:Dihydroorotate dehydrogenase, FLAVIN MONONUCLEOTIDE, OROTIC ACID, ...
Authors:Kraemer, A., Janin, Y., Arrowsmith, C.H., Edwards, A.M., Bountra, C., Knapp, S., Structural Genomics Consortium (SGC)
Deposit date:2019-09-30
Release date:2019-10-09
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Human DHODH bound to SGC chemical probe IPP/CNRS-A017-A04
To Be Published
6SYH
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WOLINELLA SUCCINOGENES L-ASPARAGINASE MUTANT V23Q,K24T IN P 22121
Descriptor:L-asparaginase
Authors:Timofeev, V.I., Kuranova, I.P.
Deposit date:2019-09-29
Release date:2019-10-09
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Wolinella succinogenes L-asparaginase mutant V23Q,K24T in P 22121
To Be Published
6UGD
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KATANIN HEXAMER IN THE SPIRAL CONFORMATION IN COMPLEX WITH SUBSTRATE
Descriptor:Meiotic spindle formation protein mei-1, Polyglutamate peptide, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Zehr, E.A., Roll-Mecak, A.
Deposit date:2019-09-26
Release date:2019-10-09
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Katanin grips the b-tubulin tail through an electropositive double spiral to sever microtubules
To Be Published
6UGE
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KATANIN HEXAMER IN THE RING CONFORMATION IN COMPLEX WITH SUBSTRATE
Descriptor:Meiotic spindle formation protein mei-1, Polyglutamate peptide, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Zehr, E.A., Roll-Mecak, A.
Deposit date:2019-09-26
Release date:2019-10-09
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Katanin grips the b-tubulin tail through an electropositive double spiral to sever microtubules
To Be Published
6UGF
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KATANIN HEXAMER IN THE RING CONFORMATION WITH RESOLVED PROTOMER ONE IN COMPLEX WITH SUBSTRATE
Descriptor:Meiotic spindle formation protein mei-1, Polyglutamate peptide, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Zehr, E.A., Roll-Mecak, A.
Deposit date:2019-09-26
Release date:2019-10-09
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Katanin grips the b-tubulin tail through an electropositive double spiral to sever microtubules
To Be Published
6UH2
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CRYSTAL STRUCTURE OF SHORT CHAIN DEHYDROGENASE FROM LEPTOSPIRA BORGPETERSENII SEROVAR HARDJO-BOVIS (STRAIN JB197) WITH BOUND NAD+
Descriptor:Short chain dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2019-09-26
Release date:2019-10-09
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:TBD
TO BE PUBLISHED
6KZC
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CRYSTAL STRUCTURE OF TRKC IN COMPLEX WITH 3-(IMIDAZO[1,2-A]PYRAZIN-3-YLETHYNYL)-2-METHYL-N-(3-((4- METHYLPIPERAZIN-1-YL)METHYL)-5- (TRIFLUOROMETHYL)PHENYL)BENZAMIDE
Descriptor:NT-3 growth factor receptor, 3-(2-imidazo[1,2-a]pyrazin-3-ylethynyl)-2-methyl-~{N}-[3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide
Authors:Zhang, Z.M., Wang, Y.
Deposit date:2019-09-23
Release date:2019-10-09
Method:X-RAY DIFFRACTION (2 Å)
Cite:Design, synthesis and biological evaluation of 3-(imidazo[1,2-a]pyrazin-3-ylethynyl)-2-methylbenzamides as potent and selective pan-tropomyosin receptor kinase (TRK) inhibitors.
Eur.J.Med.Chem., 179, 2019
6KZD
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CRYSTAL STRUCTURE OF TRKC IN COMPLEX WITH 3-((6-(4-AMINOPHENYL)IMIDAZO[1,2-A]PYRAZIN-3-YL)ETHYNYL)- N-(3-ISOPROPYL-5-((4-METHYLPIPERAZIN-1-YL)METHYL)PHENYL)-2- METHYLBENZAMIDE
Descriptor:NT-3 growth factor receptor, 3-[2-[6-(4-aminophenyl)imidazo[1,2-a]pyrazin-3-yl]ethynyl]-2-methyl-~{N}-[3-(4-methylpiperazin-1-yl)-5-propan-2-yl-phenyl]benzamide, PHOSPHATE ION
Authors:Wang, Y., Zhang, Z.M.
Deposit date:2019-09-23
Release date:2019-10-09
Method:X-RAY DIFFRACTION (1.708 Å)
Cite:Design, synthesis and biological evaluation of 3-(imidazo[1,2-a]pyrazin-3-ylethynyl)-2-methylbenzamides as potent and selective pan-tropomyosin receptor kinase (TRK) inhibitors.
Eur.J.Med.Chem., 179, 2019
6UEV
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STRUCTURE OF UNLIGANDED TRNA (GUANINE-N1)-METHYLTRANSFERASE FOUND IN ANAPLASMA PHAGOCYTOPHILUM
Descriptor:tRNA (guanine-N(1)-)-methyltransferase, GLYCEROL
Authors:Jannotta, C., Edele, D., Levanti, D., Carson, M., Prucha, G., Caesar, J., Collins, K., Garland, E., Handley-Pendleton, J., Hernandez, V., Leffler, S., Williams, D., Stojanoff, V., Perez, A., Halloran, J., Bolen, R.
Deposit date:2019-09-23
Release date:2019-10-09
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure of unliganded tRNA (guanine-N1)-methyltransferase found in Anaplasma phagocytophilum
To Be Published
6KYL
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CRYSTAL STRUCTURE OF PHOSPHATIDIC ACID TRANSPORTER UPS1/MDM35 IN COMPLEX WITH (2R)-3-(PHOSPHONOOXY)PROPANE-1,2-DIYL DIHEXANOATE
Descriptor:Mitochondrial distribution and morphology protein 35, Protein UPS1, mitochondrial, ...
Authors:Lu, J., Chan, K.C., Zhai, Y., Fan, J., Sun, F.
Deposit date:2019-09-19
Release date:2019-10-02
Method:X-RAY DIFFRACTION (3.55 Å)
Cite:Structure of a phospholipid transport complex
To Be Published
6UDA
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CRYO-EM STRUCTURE OF CH235UCA BOUND TO MAN5-ENRICHED CH505.N279K.G458Y.SOSIP.664
Descriptor:CH505.N279K.G458Y.SOSIP.664 gp120, CH235 UCA heavy chain Fab, CH505.N279K.G458Y.SOSIP.664 gp41, ...
Authors:Henderson, R., Acharya, P.
Deposit date:2019-09-19
Release date:2019-10-02
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Neutralization-guided design of HIV-1 envelope trimers with high affinity for the unmutated common ancester of CH235 lineage CD4bs broadly neutralizing antibodies.
Plos Pathog., 15, 2019
6UDS
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CRYSTAL STRUCTURE OF A PUTATIVE 3-OXOACYL-ACP REDUCTASE (FABG) FROM ACINETOBACTER BAUMANNII
Descriptor:3-oxoacyl-(Acyl-carrier-protein) reductase
Authors:Forwood, J.K., Cross, E.M.
Deposit date:2019-09-19
Release date:2019-10-09
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of a putative 3-oxoacyl-ACP reductase (FabG) from Acinetobacter baumannii
To Be Published
6KYG
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CRYSTAL STRUCTURE OF THE COMPLEX OF PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE FROM ACINETOBACTER BAUMANNII WITH PHOSPHONOACETATE AT 2.19 A RESOLUTION.
Descriptor:Phosphopantetheine adenylyltransferase, SULFATE ION, PHOSPHONOACETIC ACID, ...
Authors:Gupta, A., Viswanathan, V., Sharma, S., Singh, T.P.
Deposit date:2019-09-18
Release date:2019-10-09
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Crystal structure of the complex of phospho pantetheine adenylyl transferase from Acinetobacter baumannii with ascorbic acid (Vitamin-C) at 2.19 A resolution.
To Be Published
6KY6
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CRYSTAL STRUTURE OF A THERMOSTABLE ALDO-KETO REDUCTASE TM1743 IN COMPLEXS WITH INHIBITOR EPALRESTAT IN SPACE GROUP P3221
Descriptor:2,5-diketo-D-gluconic acid reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, {5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid, ...
Authors:Zhang, C.Y., Min, Z.Z., Liu, X.M., Wang, C., Tang, W.R.
Deposit date:2019-09-16
Release date:2019-10-02
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Crystal struture of a thermostable aldo-keto reductase Tm1743 in complexs with inhibitor epalrestat in space group P3221
To Be Published
6UAN
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B-RAF:14-3-3 COMPLEX
Descriptor:14-3-3 zeta, Serine/threonine-protein kinase B-raf
Authors:Kondo, Y., Ognjenovic, J., Banerjee, S., Karandur, D., Merk, A., Kulhanek, K., Wong, K., Roose, J.P., Subramaniam, S., Kuriyan, J.
Deposit date:2019-09-11
Release date:2019-09-25
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Cryo-EM structure of a dimeric B-Raf:14-3-3 complex reveals asymmetry in the active sites of B-Raf kinases
Science, 2019
6UB9
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CRYSTAL STRUCTURE OF TRYPTOPHAN SYNTHASE FROM M. TUBERCULOSIS - AMINOACRYLATE- AND BRD6309-BOUND FORM
Descriptor:Tryptophan synthase alpha chain, Tryptophan synthase beta chain, FORMIC ACID, ...
Authors:Chang, C., Michalska, K., Maltseva, N.I., Jedrzejczak, R., McCarren, P., Nag, P.P., Joachimiak, A., Satchell, K., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-11
Release date:2019-09-25
Method:X-RAY DIFFRACTION (2.783 Å)
Cite:Crystal structure of tryptophan synthase from M. tuberculosis - AMINOACRYLATE- AND BRD6309-BOUND FORM
To be Published
6UA1
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CRYSTAL STRUCTURE OF THE METALLO-BETA-LACTAMASE L1 FROM STENOTROPHOMONAS MALTOPHILIA IN THE NO-METAL BOUND FORM
Descriptor:Putative metallo-beta-lactamase l1 (Beta-lactamase type ii) (Ec 3.5.2.6) (Penicillinase), 1,2-ETHANEDIOL
Authors:Kim, Y., Maltseva, N., Endres, M., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-10
Release date:2019-09-18
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structure of the metallo-beta-lactamase L1 from Stenotrophomonas maltophilia in the no-metal bound form.
To Be Published
6UAC
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CRYSTAL STRUCTURE OF THE METALLO-BETA-LACTAMASE L1 FROM STENOTROPHOMONAS MALTOPHILIA IN THE COMPLEX WITH CADMIUM AND HYDROLYZED MOXOLACTAM
Descriptor:Putative metallo-beta-lactamase l1 (Beta-lactamase type ii) (Ec 3.5.2.6) (Penicillinase), 1,2-ETHANEDIOL, CADMIUM ION, ...
Authors:Kim, Y., Maltseva, N., Endres, M., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-10
Release date:2019-09-25
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal Structure of the metallo-beta-lactamase L1 from Stenotrophomonas maltophilia in the complex with cadmium and hydrolyzed moxolactam
To Be Published
6UAF
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CRYSTAL STRUCTURE OF THE METALLO-BETA-LACTAMASE L1 FROM STENOTROPHOMONAS MALTOPHILIA IN THE COMPLEX WITH HYDROLYZED IMIPNEM
Descriptor:Putative metallo-beta-lactamase l1 (Beta-lactamase type ii) (Ec 3.5.2.6) (Penicillinase), (2R,4S)-2-[(1S,2R)-1-carboxy-2-hydroxypropyl]-4-[(2-{[(Z)-iminomethyl]amino}ethyl)sulfanyl]-3,4-dihydro-2H-pyrrole-5-carboxylic acid, ZINC ION
Authors:Kim, Y., Maltseva, N., Endres, M., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-10
Release date:2019-09-18
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal Structure of the Metallo-beta-lactamase L1 from Stenotrophomonas maltophilia in the Complex with Hydrolyzed Imipnem
To Be Published
6UAH
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CRYSTAL STRUCTURE OF THE METALLO-BETA-LACTAMASE L1 FROM STENOTROPHOMONAS MALTOPHILIA IN THE COMPLEX WITH HYDROLYZED MEROPENEM
Descriptor:Putative metallo-beta-lactamase l1 (Beta-lactamase type ii) (Ec 3.5.2.6) (Penicillinase), ZINC ION, (2~{S},3~{R},4~{S})-2-[(2~{S},3~{R})-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]-4-[(3~{S},5~{S})-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl-3-methyl-3,4-dihydro-2~{H}-pyrrole-5-carboxylic acid, ...
Authors:Kim, Y., Maltseva, N., Endres, M., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-10
Release date:2019-09-18
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Crystal Structure of the Metallo-beta-Lactamase L1 from Stenotrophomonas maltophilia in the Complex with Hydrolyzed Meropenem
To Be Published
6U9C
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THE 2.2 A CRYSTAL STRUCTURE OF THE TYPE B CHLORAMPHENICOL ACETYLTRANSFERASE FROM VIBRIO CHOLERAE IN THE COMPLEX WITH ACETYL COA
Descriptor:Chloramphenicol acetyltransferase, CITRIC ACID, CHLORIDE ION, ...
Authors:Kim, Y., Maltseva, N., Stam, J., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-07
Release date:2019-09-18
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:The 2.2 A Crystal Structure of the Type B Chloramphenicol Acetyltransferase from Vibrio cholerae in the complex with Acetyl CoA
To Be Published
6U94
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STRUCTURE OF RND EFFLUX SYSTEM, OUTER MEMBRANE LIPOPROTEIN, NODT FAMILY FROM BURKHOLDERIA MALLEI ATCC 23344
Descriptor:RND efflux system, outer membrane lipoprotein, NodT family, ...
Authors:Horanyi, P.S., Fox III, D., Abendroth, J., Lorimer, D., Edwards, T., Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2019-09-06
Release date:2019-10-02
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Structure of RND efflux system, outer membrane lipoprotein, NodT family from Burkholderia mallei ATCC 23344
To Be Published
6U95
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ADENO-ASSOCIATED VIRUS STRAIN AAVHU.37 CAPSID ICOSAHEDRAL STRUCTURE
Descriptor:Capsid protein VP1
Authors:Kaelber, J.T., Yost, S.A., Firlar, E., Mercer, A.C.
Deposit date:2019-09-06
Release date:2019-09-18
Method:ELECTRON MICROSCOPY (2.56 Å)
Cite:Structure of the AAVhu.37 capsid by cryoelectron microscopy
To Be Published
6SRH
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CRYSTAL STRUCTURE OF THE ACVR1 (ALK2) KINASE IN COMPLEX WITH THE COMPOUND M4K2117
Descriptor:Activin receptor type-1, 4-methyl-3-[4-(1-methylpiperidin-4-yl)phenyl]-5-(3,4,5-trimethoxyphenyl)pyridine, 1,2-ETHANEDIOL, ...
Authors:Adamson, R.J., Williams, E.P., Smil, D., Burgess-Brown, N., von Delft, F., Arrowsmith, C.H., Edwards, A.M., Bountra, C., Bullock, A.N.
Deposit date:2019-09-05
Release date:2019-09-18
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Crystal structure of the ACVR1 (ALK2) kinase in complex with the compound M4K2117
To Be Published
6U8J
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CRYSTAL STRUCTURE OF 3-DEOXY-D-ARABINOHEPTULOSONATE-7-PHOSPHATE SYNTHASE/PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE (ARO3) FROM CANDIDA AURIS
Descriptor:Phospho-2-dehydro-3-deoxyheptonate aldolase, UNKNOWN ATOM OR ION
Authors:Michalska, K., Evdokimova, E., Semper, C., Di Leo, R., Stogios, P.J., Savchenko, A., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2019-09-05
Release date:2019-09-18
Method:X-RAY DIFFRACTION (2.492 Å)
Cite:Crystal structure of 3-deoxy-D-arabinoheptulosonate-7-phosphate synthase/phospho-2-dehydro-3-deoxyheptonate aldolase (Aro3) from Candida auris
To Be Published