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CRYSTAL STRUCTURE OF AP2 ASSOCIATED KINASE 1 COMPLEXED WITH (5P)-3-({(8R)-5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenol
Descriptor:	(5P)-3-({(8R)-5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenol, AP2-associated protein kinase 1, SULFATE ION
Authors:	Muckelbauer, J.K.
Deposit date:	2023-03-24
Release date:	2023-07-12
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Discovery of pyrrolo[2,1- f ][1,2,4]triazine-based inhibitors of adaptor protein 2-associated kinase 1 for the treatment of pain. Med.Chem.Res., 2023

6VVA

N-Acetylmannosamine-6-phosphate 2-epimerase from Staphylococcus aureus (strain MRSA USA300)
Descriptor:	CHLORIDE ION, CITRIC ACID, N-acetylmannosamine-6-phosphate 2-epimerase
Authors:	Renwick, R.C.J, Currie, M.J.
Deposit date:	2020-02-17
Release date:	2021-02-24
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (1.84 Å)
Cite:	N-acetylmannosamine-6-phosphate 2-epimerase uses a novel substrate-assisted mechanism to catalyze amino sugar epimerization. J.Biol.Chem., 297, 2021

6Q26

N-Acetylmannosamine kinase from Staphylococcus aureus
Descriptor:	Glucokinase
Authors:	Coombes, D, North, R.A, Dobson, R.C.J.
Deposit date:	2019-08-07
Release date:	2020-01-22
Last modified:	2020-03-18
Method:	X-RAY DIFFRACTION (2.328 Å)
Cite:	The basis for non-canonical ROK family function in theN-acetylmannosamine kinase from the pathogenStaphylococcus aureus. J.Biol.Chem., 295, 2020

6Q27

N-acetylmannosamine kinase with N-acetylmannosamine from Staphylococcus aureus
Descriptor:	2-acetamido-2-deoxy-alpha-D-mannopyranose, Glucokinase
Authors:	Coombes, D, Horne, C.R, Davies, J.S, Dobson, R.C.J.
Deposit date:	2019-08-07
Release date:	2020-01-22
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	The basis for non-canonical ROK family function in theN-acetylmannosamine kinase from the pathogenStaphylococcus aureus. J.Biol.Chem., 295, 2020

6Q28

Metal ROK rebel: Characterisation of N-acetylmannosamine kinase from the pathogen Staphylococcus aureus
Descriptor:	2-acetamido-2-deoxy-beta-D-glucopyranose, N-acetylmannosamine kinase
Authors:	Coombes, D, Horne, C.R, Dobson, R.C.J.
Deposit date:	2019-08-07
Release date:	2020-01-22
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	The basis for non-canonical ROK family function in theN-acetylmannosamine kinase from the pathogenStaphylococcus aureus. J.Biol.Chem., 295, 2020

7VWW

X-ray structure of a domain-swapped poly-glutamine Monellin mutant
Descriptor:	DI(HYDROXYETHYL)ETHER, Monellin chain B,Monellin chain A
Authors:	Manjula, R, Ramaswamy, S, Gosavi, S.
Deposit date:	2021-11-12
Release date:	2022-11-16
Last modified:	2023-11-29
Method:	X-RAY DIFFRACTION (2.7 Å)
Cite:	Effect of polyQ on protein assembly To Be Published

6JKU

Crystal structure of N-acetylglucosamine-6-phosphate deacetylase from Pasteurella Multocida
Descriptor:	1,2-ETHANEDIOL, GLYCEROL, N-acetylglucosamine-6-phosphate deacetylase, ...
Authors:	Manjunath, L, Bose, S, Subramanian, R.
Deposit date:	2019-03-01
Release date:	2020-03-04
Last modified:	2023-11-22
Method:	X-RAY DIFFRACTION (1.95 Å)
Cite:	Quaternary variations in the structural assembly of N-acetylglucosamine-6-phosphate deacetylase from Pasteurella multocida. Proteins, 2020

7MFS

N-Acetylmannosamine-6-phosphate 2-epimerase from Staphylococcus aureus (strain MRSA USA300) with substrate and product bound
Descriptor:	CHLORIDE ION, N-acetyl-D-glucosamine-6-phosphate, N-acetylmannosamine-6-phosphate, ...
Authors:	Currie, M.J, Dobson, R.C.J.
Deposit date:	2021-04-11
Release date:	2022-04-13
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.51 Å)
Cite:	N-acetylmannosamine-6-phosphate 2-epimerase uses a novel substrate-assisted mechanism to catalyze amino sugar epimerization. J.Biol.Chem., 297, 2021

7MFN

N-Acetylmannosamine-6-phosphate 2-epimerase E180A from Staphylococcus aureus (strain MRSA USA300)
Descriptor:	1,2-ETHANEDIOL, CHLORIDE ION, CITRIC ACID, ...
Authors:	Currie, M.J, Dobson, R.C.J.
Deposit date:	2021-04-10
Release date:	2022-04-13
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.55 Å)
Cite:	N-acetylmannosamine-6-phosphate 2-epimerase uses a novel substrate-assisted mechanism to catalyze amino sugar epimerization. J.Biol.Chem., 297, 2021

7MQT

N-Acetylmannosamine-6-phosphate 2-epimerase from Staphylococcus aureus (strain MRSA USA300) with 5-deoxy substrate bound
Descriptor:	2-acetamido-2,5-dideoxy-6-O-phosphono-D-lyxo-hexose, CHLORIDE ION, CITRIC ACID, ...
Authors:	Currie, M.J, Dobson, R.C.J.
Deposit date:	2021-05-06
Release date:	2022-04-20
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.88 Å)
Cite:	N-acetylmannosamine-6-phosphate 2-epimerase uses a novel substrate-assisted mechanism to catalyze amino sugar epimerization. J.Biol.Chem., 297, 2021

7O2Y

Sandercyanin Fluorescent Protein variant V71E bound to biliverdin IX-alpha
Descriptor:	BILIVERDINE IX ALPHA, Sandercyanin Fluorescent Protein
Authors:	Ghosh, S, Yadav, K, Ramaswamy, S.
Deposit date:	2021-03-31
Release date:	2022-04-13
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (2.5 Å)
Cite:	Modulation of biliverdin dynamics and spectral properties by Sandercyanin. Rsc Adv, 12, 2022

7O3K

Structure of a monomeric variant (L135E) of Sandercyanin fluorescent protein bound to biliverdin IX-alpha
Descriptor:	BILIVERDINE IX ALPHA, Sandercyanin Fluorescent Protein
Authors:	Ghosh, S, Yadav, K, Ramaswamy, S.
Deposit date:	2021-04-01
Release date:	2022-04-13
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (2.75 Å)
Cite:	Modulation of biliverdin dynamics and spectral properties by Sandercyanin. Rsc Adv, 12, 2022

7P2B

Crystal structure of human gelsolin amyloid mutant A551P
Descriptor:	CHLORIDE ION, GLYCEROL, Gelsolin, ...
Authors:	Bollati, M, de Rosa, M.
Deposit date:	2021-07-05
Release date:	2022-05-18
Last modified:	2024-01-31
Method:	X-RAY DIFFRACTION (3 Å)
Cite:	A novel hotspot of gelsolin instability triggers an alternative mechanism of amyloid aggregation. Comput Struct Biotechnol J, 19, 2021

6XT2

EQADH-NADH-HEPTAFLUOROBUTANOL, P21
Descriptor:	(4R)-2-METHYLPENTANE-2,4-DIOL, 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, 2,2,3,3,4,4,4-heptafluorobutan-1-ol, ...
Authors:	Plapp, B.V, Ramaswamy, S.
Deposit date:	2020-07-16
Release date:	2020-08-05
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (1.55 Å)
Cite:	Alternative binding modes in abortive NADH-alcohol complexes of horse liver alcohol dehydrogenase. Arch.Biochem.Biophys., 701, 2021

6B8F

Contracted Human Heavy-Chain Ferritin Crystal-Hydrogel Hybrid
Descriptor:	CALCIUM ION, FE (III) ION, Ferritin heavy chain
Authors:	Zhang, L, Bailey, J.B, Subramanian, R, Tezcan, F.A.
Deposit date:	2017-10-07
Release date:	2018-05-02
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (1.06 Å)
Cite:	Hyperexpandable, self-healing macromolecular crystals with integrated polymer networks. Nature, 557, 2018

6B8G

Twice-Contracted Human Heavy-Chain Ferritin Crystal-Hydrogel Hybrid
Descriptor:	CALCIUM ION, FE (III) ION, Ferritin heavy chain
Authors:	Zhang, L, Bailey, J.B, Subramanian, R, Tezcan, F.A.
Deposit date:	2017-10-07
Release date:	2018-05-02
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (1.13 Å)
Cite:	Hyperexpandable, self-healing macromolecular crystals with integrated polymer networks. Nature, 557, 2018

5ZJP

Structure of N-acetylmannosamine-6-phosphate-2-epimerase from Vibrio cholerae with N-acetylglucosamine-6-phosphate
Descriptor:	1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, N-acetyl-D-glucosamine-6-phosphate, ...
Authors:	Manjunath, L, Guntupalli, S.R.
Deposit date:	2018-03-21
Release date:	2018-12-05
Last modified:	2024-03-27
Method:	X-RAY DIFFRACTION (2.66 Å)
Cite:	Crystal structures and kinetic analyses of N-acetylmannosamine-6-phosphate 2-epimerases from Fusobacterium nucleatum and Vibrio cholerae Acta Crystallogr F Struct Biol Commun, 74, 2018

5ZJB

Structure of N-acetylmannosamine-6-phosphate-2-epimerase from Vibrio cholerae
Descriptor:	DI(HYDROXYETHYL)ETHER, MALONATE ION, Putative N-acetylmannosamine-6-phosphate 2-epimerase
Authors:	Manjunath, L, Guntupalli, S.
Deposit date:	2018-03-19
Release date:	2018-09-19
Last modified:	2023-11-22
Method:	X-RAY DIFFRACTION (1.699 Å)
Cite:	Crystal structures and kinetic analyses of N-acetylmannosamine-6-phosphate 2-epimerases from Fusobacterium nucleatum and Vibrio cholerae Acta Crystallogr F Struct Biol Commun, 74, 2018

5ZKN

Structure of N-acetylmannosamine-6-phosphate 2-epimerase from Fusobacterium nucleatum
Descriptor:	CHLORIDE ION, Putative N-acetylmannosamine-6-phosphate 2-epimerase
Authors:	Manjunath, L.
Deposit date:	2018-03-24
Release date:	2018-09-19
Last modified:	2024-03-27
Method:	X-RAY DIFFRACTION (2.205 Å)
Cite:	Crystal structures and kinetic analyses of N-acetylmannosamine-6-phosphate 2-epimerases from Fusobacterium nucleatum and Vibrio cholerae Acta Crystallogr F Struct Biol Commun, 74, 2018

5ZJN

Structure of N-acetylmannosamine-6-phosphate-2-epimerase from Vibrio cholerae with N-acetylmannosamine-6-phosphate
Descriptor:	1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, N-acetylmannosamine-6-phosphate, ...
Authors:	Manjunath, L, Guntupalli, S.
Deposit date:	2018-03-21
Release date:	2018-09-19
Last modified:	2024-03-27
Method:	X-RAY DIFFRACTION (2.66 Å)
Cite:	Crystal structures and kinetic analyses of N-acetylmannosamine-6-phosphate 2-epimerases from Fusobacterium nucleatum and Vibrio cholerae Acta Crystallogr F Struct Biol Commun, 74, 2018

6MCU

Crystal structure of the holo retinal-bound domain-swapped dimer Q108K:T51D:A28H mutant of human Cellular Retinol Binding Protein II
Descriptor:	GLYCEROL, RETINAL, Retinol-binding protein 2
Authors:	Ghanbarpour, A, Geiger, J.
Deposit date:	2018-09-02
Release date:	2019-10-16
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.572 Å)
Cite:	Engineering the hCRBPII Domain-Swapped Dimer into a New Class of Protein Switches. J.Am.Chem.Soc., 141, 2019

6E6L

Crystal structure of the holo retinal-bound domain-swapped dimer Q108K:K40L:T51F:Y60A mutant of human cellular retinol binding protein II
Descriptor:	ACETATE ION, RETINAL, Retinol-binding protein 2
Authors:	Ghanbarpour, A, Geiger, J.
Deposit date:	2018-07-25
Release date:	2019-10-16
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.08 Å)
Cite:	Engineering the hCRBPII Domain-Swapped Dimer into a New Class of Protein Switches. J.Am.Chem.Soc., 141, 2019

6MCV

Crystal Structure of Holo Retinal-Bound Domain-Swapped Dimer of Wild Type Human Cellular Retinol Binding Protein II
Descriptor:	RETINAL, Retinol-binding protein 2
Authors:	Ghanbarpour, A, Geiger, J.
Deposit date:	2018-09-02
Release date:	2019-10-16
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (3.3 Å)
Cite:	Engineering the hCRBPII Domain-Swapped Dimer into a New Class of Protein Switches. J.Am.Chem.Soc., 141, 2019

6MLB

Crystal structure of the holo retinal-bound domain-swapped dimer Q108K:K40L:T51F mutant of human cellular retinol binding protein II
Descriptor:	ACETATE ION, GLYCEROL, RETINAL, ...
Authors:	Ghanbarpour, A, Geiger, J.
Deposit date:	2018-09-27
Release date:	2019-10-16
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.15 Å)
Cite:	Engineering the hCRBPII Domain-Swapped Dimer into a New Class of Protein Switches. J.Am.Chem.Soc., 141, 2019

6MKV

Crystal structure of Retinal-bound holo Q108K:K40L:T51W domain-swapped dimer of human cellular retinol binding protein 2
Descriptor:	ACETATE ION, GLYCEROL, RETINAL, ...
Authors:	Ghanbarpour, A, Geiger, J.
Deposit date:	2018-09-26
Release date:	2019-10-16
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.107 Å)
Cite:	Engineering the hCRBPII Domain-Swapped Dimer into a New Class of Protein Switches. J.Am.Chem.Soc., 141, 2019

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