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4HK8
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CRYSTAL STRUCTURES OF MUTANT ENDO- -1,4-XYLANASE II COMPLEXED WITH SUBSTRATE (1.15 A) AND PRODUCTS (1.6 A)
Descriptor:Endo-1,4-beta-xylanase 2, BETA-D-XYLOPYRANOSE, GLYCEROL, ...
Authors:Langan, P., Wan, Q., Coates, L., Kovalevsky, A.
Deposit date:2012-10-15
Release date:2014-01-08
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.151 Å)
Cite:X-ray crystallographic studies of family 11 xylanase Michaelis and product complexes: implications for the catalytic mechanism.
Acta Crystallogr.,Sect.D, 70, 2014
4HK9
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CRYSTAL STRUCTURES OF MUTANT ENDO-BETA-1,4-XYLANASE II COMPLEXED WITH SUBSTRATE (1.15 A) AND PRODUCTS (1.6 A)
Descriptor:Endo-1,4-beta-xylanase 2, BETA-D-XYLOPYRANOSE
Authors:Langan, P., Wan, Q., Coates, L., Kovalevsky, A.
Deposit date:2012-10-15
Release date:2014-01-08
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:X-ray crystallographic studies of family 11 xylanase Michaelis and product complexes: implications for the catalytic mechanism.
Acta Crystallogr.,Sect.D, 70, 2014
4HKL
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CRYSTAL STRUCTURES OF MUTANT ENDO-BETA-1,4-XYLANASE II COMPLEXED WITH SUBSTRATE (1.15 A) AND PRODUCTS (1.6 A)
Descriptor:Endo-1,4-beta-xylanase 2, IODIDE ION
Authors:Langan, P., Wan, Q., Coates, L., Kovalevsky, A.
Deposit date:2012-10-15
Release date:2014-01-08
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:X-ray crystallographic studies of family 11 xylanase Michaelis and product complexes: implications for the catalytic mechanism.
Acta Crystallogr.,Sect.D, 70, 2014
4HKO
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CRYSTAL STRUCTURES OF MUTANT ENDO-BETA-1,4-XYLANASE II (E177Q) IN THE APO FORM
Descriptor:Endo-1,4-beta-xylanase 2, IODIDE ION
Authors:Langan, P., Wan, Q., Coates, L., Kovalevsky, A.
Deposit date:2012-10-15
Release date:2014-01-08
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:X-ray crystallographic studies of family 11 xylanase Michaelis and product complexes: implications for the catalytic mechanism.
Acta Crystallogr.,Sect.D, 70, 2014
4QDP
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JOINT X-RAY AND NEUTRON STRUCTURE OF STREPTOMYCES RUBIGINOSUS D-XYLOSE ISOMERASE IN COMPLEX WITH TWO CD2+ IONS AND CYCLIC BETA-L-ARABINOSE
Descriptor:Xylose isomerase, CADMIUM ION, BETA-L-ARABINOSE
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-14
Release date:2014-09-03
Last modified:2018-06-20
Method:NEUTRON DIFFRACTION (2 Å), X-RAY DIFFRACTION
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4QDW
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JOINT X-RAY AND NEUTRON STRUCTURE OF STREPTOMYCES RUBIGINOSUS D-XYLOSE ISOMERASE IN COMPLEX WITH TWO NI2+ IONS AND LINEAR L-ARABINOSE
Descriptor:Xylose isomerase, NICKEL (II) ION, L-arabinose
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-14
Release date:2014-09-03
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.8 Å), NEUTRON DIFFRACTION
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4QE1
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ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE IN COMPLEX WITH TWO CD2+ IONS AND L-RIBULOSE
Descriptor:Xylose isomerase, CADMIUM ION, alpha-L-ribulofuranose
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-15
Release date:2014-09-03
Last modified:2014-09-10
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4QE4
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ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE IN COMPLEX WITH TWO NI2+ IONS AND L-RIBULOSE
Descriptor:Xylose isomerase, NICKEL (II) ION, beta-L-ribulofuranose
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-15
Release date:2014-09-03
Last modified:2014-09-10
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4QE5
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ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE IN COMPLEX WITH TWO MG2+ IONS AND L-RIBULOSE
Descriptor:Xylose isomerase, MAGNESIUM ION, alpha-L-ribulofuranose
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-15
Release date:2014-09-03
Last modified:2014-09-10
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4QEE
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ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE IN COMPLEX WITH TWO NI2+ IONS AND L-RIBOSE
Descriptor:Xylose isomerase, NICKEL (II) ION, alpha-L-ribofuranose
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-15
Release date:2014-09-03
Last modified:2014-09-10
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4QEH
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ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE IN COMPLEX WITH TWO MG2+ IONS AND L-RIBOSE
Descriptor:Xylose isomerase, MAGNESIUM ION, beta-L-ribofuranose
Authors:Kovalevsky, A.Y., Langan, P.
Deposit date:2014-05-16
Release date:2014-09-03
Last modified:2014-09-10
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:L-Arabinose Binding, Isomerization, and Epimerization by D-Xylose Isomerase: X-Ray/Neutron Crystallographic and Molecular Simulation Study.
Structure, 22, 2014
4XPV
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NEUTRON AND X-RAY STRUCTURE ANALYSIS OF XYLANASE: N44D AT PH6
Descriptor:Endo-1,4-beta-xylanase 2, IODIDE ION
Authors:Wan, Q., Park, J.M., Riccardi, D.M., Hanson, L.B., Fisher, Z., Smith, J.C., Ostermann, A., Schrader, T., Graham, D.E., Coates, L., Langan, P., Kovalevsky, A.Y.
Deposit date:2015-01-18
Release date:2015-09-30
Last modified:2018-04-25
Method:X-RAY DIFFRACTION (1.7 Å), NEUTRON DIFFRACTION
Cite:Direct determination of protonation states and visualization of hydrogen bonding in a glycoside hydrolase with neutron crystallography.
Proc.Natl.Acad.Sci.USA, 112, 2015
4XQ4
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X-RAY STRUCTURE ANALYSIS OF XYLANASE - N44D
Descriptor:Endo-1,4-beta-xylanase 2, IODIDE ION
Authors:Wan, Q., Park, J.M., Riccardi, D.M., Hanson, L.B., Fisher, Z., Smith, J.C., Ostermann, A., Schrader, T., Graham, D.E., Coates, L., Langan, P., Kovalevsky, A.Y.
Deposit date:2015-01-19
Release date:2015-09-23
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Direct determination of protonation states and visualization of hydrogen bonding in a glycoside hydrolase with neutron crystallography.
Proc.Natl.Acad.Sci.USA, 112, 2015
4XQD
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X-RAY STRUCTURE ANALYSIS OF XYLANASE-WT AT PH4.0
Descriptor:Endo-1,4-beta-xylanase 2, IODIDE ION, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
Authors:Wan, Q., Park, J.M., Riccardi, D.M., Hanson, L.B., Fisher, Z., Smith, J.C., Ostermann, A., Schrader, T., Graham, D.E., Coates, L., Langan, P., Kovalevsky, A.Y.
Deposit date:2015-01-19
Release date:2015-09-23
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Direct determination of protonation states and visualization of hydrogen bonding in a glycoside hydrolase with neutron crystallography.
Proc.Natl.Acad.Sci.USA, 112, 2015
4XQW
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X-RAY STRUCTURE ANALYSIS OF XYLANASE-N44E WITH MES AT PH6.0
Descriptor:Endo-1,4-beta-xylanase 2, IODIDE ION, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID
Authors:Wan, Q., Park, J.M., Riccardi, D.M., Hanson, L.B., Fisher, Z., Smith, J.C., Ostermann, A., Schrader, T., Graham, D.E., Coates, L., Langan, P., Kovalevsky, A.Y.
Deposit date:2015-01-20
Release date:2015-09-23
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Direct determination of protonation states and visualization of hydrogen bonding in a glycoside hydrolase with neutron crystallography.
Proc.Natl.Acad.Sci.USA, 112, 2015
3L45
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A JOINT NEUTRON AND X-RAY STRUCTURE OF OXIDIZED AMICYANIN
Descriptor:Amicyanin, COPPER (II) ION
Authors:Sukumar, N., Mathews, F.S., Langan, P., Davidson, V.L.
Deposit date:2009-12-18
Release date:2010-04-28
Last modified:2018-04-25
Method:NEUTRON DIFFRACTION (1.8 Å), X-RAY DIFFRACTION
Cite:A joint x-ray and neutron study on amicyanin reveals the role of protein dynamics in electron transfer.
Proc.Natl.Acad.Sci.USA, 107, 2010
5C6E
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JOINT X-RAY/NEUTRON STRUCTURE OF EQUINE CYANOMET HEMOGLOBIN IN R STATE
Descriptor:Hemoglobin subunit alpha, Hemoglobin subunit beta, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Dajnowicz, S., Sean, S., Hanson, B.L., Fisher, S.Z., Langan, P., Kovalevsky, A.Y., Mueser, T.C.
Deposit date:2015-06-22
Release date:2016-06-22
Last modified:2018-04-25
Method:X-RAY DIFFRACTION (1.7 Å), NEUTRON DIFFRACTION
Cite:Visualizing the Bohr effect in hemoglobin: neutron structure of equine cyanomethemoglobin in the R state and comparison with human deoxyhemoglobin in the T state.
Acta Crystallogr D Struct Biol, 72, 2016
2QWS
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NEUTRON AND X-RAY STRUCTURAL STUDIES OF SHORT HYDROGEN BONDS IN PHOTOACTIVE YELLOW PROTEIN (PYP)
Descriptor:Photoactive yellow protein, 4'-HYDROXYCINNAMIC ACID
Authors:Fisher, S.Z., Langan, P.
Deposit date:2007-08-10
Release date:2008-03-18
Last modified:2018-04-25
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Neutron and X-ray structural studies of short hydrogen bonds in photoactive yellow protein (PYP)
Acta Crystallogr.,Sect.D, 63, 2007
2GVE
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TIME-OF-FLIGHT NEUTRON DIFFRACTION STRUCTURE OF D-XYLOSE ISOMERASE
Descriptor:Xylose isomerase, COBALT (II) ION
Authors:Katz, A.K., Li, X., Carrell, H.L., Hanson, B.L., Langan, P., Coates, L., Schoenborn, B.P., Glusker, J.P., Bunick, G.J.
Deposit date:2006-05-02
Release date:2006-05-16
Last modified:2017-10-18
Method:NEUTRON DIFFRACTION (2.2 Å)
Cite:Locating active-site hydrogen atoms in D-xylose isomerase: Time-of-flight neutron diffraction.
Proc.Natl.Acad.Sci.Usa, 103, 2006
2PKY
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THE EFFECT OF DEUTERATION ON PROTEIN STRUCTURE A HIGH RESOLUTION COMPARISON OF HYDROGENOUS AND PERDEUTERATED HALOALKANE DEHALOGENASE
Descriptor:Haloalkane dehalogenase
Authors:Liu, X., Hanson, L., Langan, P., Viola, R.E.
Deposit date:2007-04-18
Release date:2007-09-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:The effect of deuteration on protein structure: a high-resolution comparison of hydrogenous and perdeuterated haloalkane dehalogenase.
Acta Crystallogr.,Sect.D, 63, 2007
2YXP
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THE EFFECT OF DEUTERATION ON PROTEIN STRUCTURE A HIGH RESOLUTION COMPARISON OF HYDROGENOUS AND PERDEUTERATED HALOALKANE DEHALOGENASE
Descriptor:Haloalkane dehalogenase
Authors:Liu, X., Hanson, L., Langan, P., Viola, R.E.
Deposit date:2007-04-27
Release date:2007-09-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:The effect of deuteration on protein structure: a high-resolution comparison of hydrogenous and perdeuterated haloalkane dehalogenase.
Acta Crystallogr.,Sect.D, 63, 2007
3BYC
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JOINT NEUTRON AND X-RAY STRUCTURE OF DIISOPROPYL FLUOROPHOSPHATASE. DEUTERIUM OCCUPANCIES ARE 1-Q, WHERE Q IS OCCUPANCY OF H
Descriptor:Diisopropyl-fluorophosphatase, CALCIUM ION
Authors:Blum, M.-M., Mustyakimov, M., Ruterjans, H., Schoenborn, B.P., Langan, P., Chen, J.C.-H.
Deposit date:2008-01-15
Release date:2009-01-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å), NEUTRON DIFFRACTION
Cite:Rapid determination of hydrogen positions and protonation states of diisopropyl fluorophosphatase by joint neutron and X-ray diffraction refinement.
Proc.Natl.Acad.Sci.Usa, 106, 2009
3CWH
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D-XYLOSE ISOMERASE IN COMPLEX WITH LINEAR PRODUCT, PER-DEUTERATED XYLULOSE
Descriptor:Xylose isomerase, D-XYLULOSE, MAGNESIUM ION, ...
Authors:Kovalevsky, A.Y., Langan, P., Glusker, J.P.
Deposit date:2008-04-21
Release date:2008-08-05
Last modified:2011-07-13
Method:NEUTRON DIFFRACTION (2.2 Å)
Cite:Hydrogen location in stages of an enzyme-catalyzed reaction: time-of-flight neutron structure of D-xylose isomerase with bound D-xylulose
Biochemistry, 47, 2008
3KBJ
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ROOM TEMPERATURE X-RAY STRUCTURE OF APO-D-XYLOSE ISOMERASE
Descriptor:Xylose isomerase
Authors:Kovalevsky, A.Y., Hanson, L., Langan, P.
Deposit date:2009-10-20
Release date:2010-09-29
Last modified:2011-08-31
Method:X-RAY DIFFRACTION (2 Å)
Cite:Identification of the Elusive Hydronium Ion Exchanging Roles with a Proton in an Enzyme at Lower pH Values.
Angew.Chem.Int.Ed.Engl., 50, 2011
3KBM
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ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE COMPLEXED WITH 2CD(2+) CO-FACTORS AND D12-D-ALPHA-GLUCOSE IN THE CYCLIC FORM
Descriptor:Xylose isomerase, CADMIUM ION, ALPHA-D-GLUCOSE
Authors:Kovalevsky, A.Y., Hanson, L., Langan, P.
Deposit date:2009-10-20
Release date:2010-06-16
Last modified:2012-03-07
Method:X-RAY DIFFRACTION (2 Å)
Cite:Metal ion roles and the movement of hydrogen during reaction catalyzed by D-xylose isomerase: a joint x-ray and neutron diffraction study.
Structure, 18, 2010