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5ZXB
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CRYSTAL STRUCTURE OF ACK1 WITH COMPOUND 10D
Descriptor:Activated CDC42 kinase 1, N-{3-[7-{[6-(4-acetylpiperazin-1-yl)pyridin-3-yl]amino}-1-methyl-2-oxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-4-methylphenyl}-3-(trifluoromethyl)benzamide
Authors:Hong, E.M., Kim, H.L., Sim, T.B.
Deposit date:2018-05-18
Release date:2018-09-26
Last modified:2018-10-10
Method:X-RAY DIFFRACTION (2.198 Å)
Cite:First SAR Study for Overriding NRAS Mutant Driven Acute Myeloid Leukemia.
J. Med. Chem., 61, 2018
6CDH
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CRYSTAL STRUCTURE OF FERROUS FORM OF THE CL-TYR157 HUMAN CYSTEINE DIOXYGENASE WITH BOTH UNCROSSLINKED AND CROSSLINKED COFACTOR
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, SULFATE ION, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2018-02-08
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (1.821 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6CDN
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CRYSTAL STRUCTURE OF CYSTEINE-BOUND FERROUS FORM OF THE CROSSLINKED CL-TYR157 HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, CYSTEINE, FE (II) ION, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2018-02-08
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.055 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BPS
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CRYSTAL STRUCTURE OF CYSTEINE-BOUND FERROUS FORM OF THE UNCROSSLINKED F2-TYR157 HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, CYSTEINE, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-11-26
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BPT
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CRYSTAL STRUCTURE OF FERROUS FORM OF THE UNCROSSLINKED F2-TYR157 HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, SULFATE ION, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-11-26
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.402 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BPU
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CRYSTAL STRUCTURE OF FERROUS FORM OF THE F2-TYR157 HUMAN CYSTEINE DIOXYGENASE WITH BOTH UNCROSSLINKED AND CROSSLINKED COFACTOR
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, SULFATE ION, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-11-26
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BPV
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CRYSTAL STRUCTURE OF CYSTEINE-BOUND FERROUS FORM OF THE MATURED F2-TYR157 HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, CYSTEINE, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-11-26
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BPW
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CRYSTAL STRUCTURE OF FERROUS FORM OF THE CL2-TYR157 HUMAN CYSTEINE DIOXYGENASE WITH BOTH UNCROSSLINKED AND CROSSLINKED COFACTOR
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, GLYCEROL, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-11-26
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BPX
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CRYSTAL STRUCTURE OF CYSTEINE-BOUND FERROUS FORM OF THE MATURED CL2-TYR157 HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, CYSTEINE, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-11-26
Release date:2018-07-04
Last modified:2019-02-20
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
6BGF
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CRYSTAL STRUCTURE OF CYSTEINE-BOUND FERROUS FORM OF THE CROSSLINKED HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, CYSTEINE, FE (II) ION, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-10-28
Release date:2017-12-13
Last modified:2018-01-17
Method:X-RAY DIFFRACTION (2.251 Å)
Cite:Crystal structure of cysteine-bound ferrous form of the crosslinked human cysteine dioxygenase.
To Be Published
6BGM
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CRYSTAL STRUCTURE OF FERROUS FORM OF THE CROSSLINKED HUMAN CYSTEINE DIOXYGENASE
Descriptor:Cysteine dioxygenase type 1, FE (II) ION, SULFATE ION, ...
Authors:Liu, A., Li, J., Shin, I.
Deposit date:2017-10-28
Release date:2017-11-22
Last modified:2018-08-29
Method:X-RAY DIFFRACTION (2.206 Å)
Cite:Cleavage of a carbon-fluorine bond by an engineered cysteine dioxygenase.
Nat. Chem. Biol., 14, 2018
5KLK
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CRYSTAL STRUCTURE OF 2-AMINOMUCONATE 6-SEMIALDEHYDE DEHYDROGENASE N169D IN COMPLEX WITH NAD+ AND 2-HYDROXYMUCONATE-6-SEMIALDEHYDE
Descriptor:2-aminomuconate 6-semialdehyde dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, (2E,4E)-2-hydroxy-6-oxohexa-2,4-dienoic acid, ...
Authors:Yang, Y., Davis, I., Ha, U., Wang, Y., Shin, I., Liu, A.
Deposit date:2016-06-24
Release date:2016-11-09
Method:X-RAY DIFFRACTION (2.006 Å)
Cite:Crystal structure of 2-aminomuconate 6-semialdehyde dehydrogenase N169D in ternary complex with NAD+ and substrate analogue 2-hydroxymuconate-6-semialdehyde
To Be Published
5KLL
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CRYSTAL STRUCTURE OF 2-HYDROXYMUCONATE-6-SEMIALDEHYDE DERIVED TAUTOMERIC INTERMEDIATE IN 2-AMINOMUCONATE 6-SEMIALDEHYDE DEHYDROGENASE N169D
Descriptor:2-aminomuconate 6-semialdehyde dehydrogenase, (3~{E},5~{E})-6-oxidanyl-2-oxidanylidene-hexa-3,5-dienoic acid, SODIUM ION
Authors:Yang, Y., Davis, I., Ha, U., Wang, Y., Shin, I., Liu, A.
Deposit date:2016-06-24
Release date:2016-11-09
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Crystal structure of 2-aminomuconate 6-semialdehyde dehydrogenase N169D in complex with NAD+, 5 min after soaking with alternative substrate
To Be Published
5KLM
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CRYSTAL STRUCTURE OF 2-HYDROXYMUCONATE-6-SEMIALDEHYDE DERIVED INTERMEDIATE IN NAD(+)-BOUND 2-AMINOMUCONATE 6-SEMIALDEHYDE DEHYDROGENASE N169D
Descriptor:2-aminomuconate 6-semialdehyde dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SODIUM ION
Authors:Yang, Y., Davis, I., Ha, U., Wang, Y., Shin, I., Liu, A.
Deposit date:2016-06-24
Release date:2016-11-09
Method:X-RAY DIFFRACTION (2.102 Å)
Cite:Crystal structure of 2-aminomuconate 6-semialdehyde dehydrogenase N169D in complex with NAD+, 30 min after soaking with alternative substrate
To Be Published
5KLN
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CRYSTAL STRUCTURE OF 2-AMINOMUCONATE 6-SEMIALDEHYDE DEHYDROGENASE N169A IN COMPLEX WITH NAD+
Descriptor:2-aminomuconate 6-semialdehyde dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SODIUM ION
Authors:Yang, Y., Davis, I., Ha, U., Wang, Y., Shin, I., Liu, A.
Deposit date:2016-06-24
Release date:2016-11-09
Method:X-RAY DIFFRACTION (1.992 Å)
Cite:Crystal structure of 2-aminomuconate 6-semialdehyde dehydrogenase N169A in binary complex with NAD+
To Be Published
5KLO
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CRYSTAL STRUCTURE OF THIOACYL INTERMEDIATE IN 2-AMINOMUCONATE 6-SEMIALDEHYDE DEHYDROGENASE N169A
Descriptor:2-aminomuconate 6-semialdehyde dehydrogenase, (2Z,4E)-2-hydroxy-6-oxohexa-2,4-dienoic acid, SODIUM ION, ...
Authors:Yang, Y., Davis, I., Ha, U., Wang, Y., Shin, I., Liu, A.
Deposit date:2016-06-24
Release date:2016-11-09
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Crystal structure of 2-aminomuconate 6-semialdehyde dehydrogenase N169A in complex with NADH and intermediate
To Be Published
5KJ5
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CRYSTAL STRUCTURE OF 2-AMINOMUCONATE 6-SEMIALDEHYDE DEHYDROGENASE N169D IN COMPLEX WITH NAD+
Descriptor:2-aminomuconate 6-semialdehyde dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Yang, Y., Davis, I., Ha, U., Wang, Y., Shin, I., Liu, A.
Deposit date:2016-06-17
Release date:2016-11-09
Method:X-RAY DIFFRACTION (2.113 Å)
Cite:Crystal structure of 2-aminomuconate 6-semialdehyde dehydrogenase N169D in binary complex with NAD+
To Be Published
4RSW
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THE STRUCTURE OF THE EFFECTOR PROTEIN FROM PSEUDOMONAS SYRINGAE PV. SYRINGAE STRAIN 61
Descriptor:HopA1
Authors:Park, Y., Shin, I., Rhee, S.
Deposit date:2014-11-11
Release date:2015-03-11
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of the effector protein HopA1 from Pseudomonas syringae
J.Struct.Biol., 189, 2015
4RSX
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THE STRUCTURE OF THE EFFECTOR PROTEIN FROM PSEUDOMONAS SYRINGAE PV. TOMATO STRAIN DC3000
Descriptor:Type III effector HopA1
Authors:Park, Y., Shin, I., Rhee, S.
Deposit date:2014-11-11
Release date:2015-03-11
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.303 Å)
Cite:Crystal structure of the effector protein HopA1 from Pseudomonas syringae
J.Struct.Biol., 189, 2015
4PXB
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THE CRYSTAL STRUCTURE OF ATUAH IN COMPLEX WITH (S)-UREIDOGLYCOLATE
Descriptor:Ureidoglycolate hydrolase, MANGANESE (II) ION, (2S)-(carbamoylamino)(hydroxy)ethanoic acid
Authors:Shin, I., Rhee, S.
Deposit date:2014-03-23
Release date:2014-07-23
Method:X-RAY DIFFRACTION (1.903 Å)
Cite:Structural Insights into the Substrate Specificity of (S)-Ureidoglycolate Amidohydrolase and Its Comparison with Allantoate Amidohydrolase
J.Mol.Biol., 2014
4PXC
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THE CRYSTAL STRUCTURE OF ATUAH IN COMPLEX WITH (S)-HYDROXYGLYCINE
Descriptor:Ureidoglycolate hydrolase, MANGANESE (II) ION, (2S)-amino(hydroxy)ethanoic acid
Authors:Shin, I., Rhee, S.
Deposit date:2014-03-23
Release date:2014-07-23
Method:X-RAY DIFFRACTION (1.893 Å)
Cite:Structural Insights into the Substrate Specificity of (S)-Ureidoglycolate Amidohydrolase and Its Comparison with Allantoate Amidohydrolase
J.Mol.Biol., 2014
4PXD
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THE CRYSTAL STRUCTURE OF ECAAH IN COMPLEX WITH ALLANTOATE
Descriptor:Allantoate amidohydrolase, MANGANESE (II) ION, ALLANTOATE ION
Authors:Shin, I., Rhee, S.
Deposit date:2014-03-23
Release date:2014-07-23
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural Insights into the Substrate Specificity of (S)-Ureidoglycolate Amidohydrolase and Its Comparison with Allantoate Amidohydrolase
J.Mol.Biol., 2014
4PXE
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THE CRYSTAL STRUCTURE OF ATUAH IN COMPLEX WITH GLYOXYLATE
Descriptor:Ureidoglycolate hydrolase, MANGANESE (II) ION, GLYOXYLIC ACID
Authors:Shin, I., Rhee, S.
Deposit date:2014-03-23
Release date:2014-07-23
Method:X-RAY DIFFRACTION (1.449 Å)
Cite:Structural Insights into the Substrate Specificity of (S)-Ureidoglycolate Amidohydrolase and Its Comparison with Allantoate Amidohydrolase
J.Mol.Biol., 2014
4H8A
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CRYSTAL STRUCTURE OF UREIDOGLYCOLATE DEHYDROGENASE IN BINARY COMPLEX WITH NADH
Descriptor:Ureidoglycolate dehydrogenase, 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE
Authors:Rhee, S., Shin, I., Kim, M.
Deposit date:2012-09-22
Release date:2013-01-16
Last modified:2018-04-11
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Structural and functional insights into (s)-ureidoglycolate dehydrogenase, a metabolic branch point enzyme in nitrogen utilization.
Plos One, 7, 2012
4FJS
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CRYSTAL STRUCTURE OF UREIDOGLYCOLATE DEHYDROGENASE ENZYME IN APO FORM
Descriptor:Ureidoglycolate dehydrogenase
Authors:Kim, M.I., Shin, I., Lee, J., Rhee, S.
Deposit date:2012-06-12
Release date:2013-01-16
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:Structural and functional insights into (s)-ureidoglycolate dehydrogenase, a metabolic branch point enzyme in nitrogen utilization.
Plos One, 7, 2012
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