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PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000013514509
Descriptor:	2-AMINOQUINAZOLIN-4(3H)-ONE, Non-structural protein 3
Authors:	Correy, G.C, Young, I.D, Thompson, M.C, Fraser, J.S.
Deposit date:	2020-10-02
Release date:	2020-12-16
Last modified:	2024-05-22
Method:	X-RAY DIFFRACTION (1.52 Å)
Cite:	Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021

8R8I

Ensemble-refined carboxymyoglobin photolysis power titration, 56 mJ/cm2
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-29
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9D

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 399 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9P

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 1297 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RAB

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 1112 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R8H

Ensemble-refined carboxymyoglobin photolysis power titration, 31 mJ/cm2
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-29
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R8G

Ensemble-refined carboxymyoglobin photolysis power titration, 18 mJ/cm2
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-29
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R95

Multicopy-refined carboxymyoglobin photolysis time series at 5 mJ/cm2 laser fluence, 1401 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R93

Multicopy-refined carboxymyoglobin photolysis time series at 5 mJ/cm2 laser fluence, 847 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9M

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 1143 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9L

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 1036 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RA9

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 907 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RA7

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 722 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R90

Multicopy-refined carboxymyoglobin photolysis time series at 5 mJ/cm2 laser fluence, 604 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9G

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 600 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RA3

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 462 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RAE

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 1303 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R94

Multicopy-refined carboxymyoglobin photolysis time series at 5 mJ/cm2 laser fluence, 1001 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R8W

Multicopy-refined carboxymyoglobin photolysis time series at 5 mJ/cm2 laser fluence, 254 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9K

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 922 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9E

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 469 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RA8

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 802 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R9Q

Multicopy-refined carboxymyoglobin photolysis time series at 23 mJ/cm2 laser fluence, 1373 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-30
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8RAC

Multicopy-refined carboxymyoglobin photolysis time series at 101 mJ/cm2 laser fluence, 1174 fs time delay
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-12-01
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

8R8F

Ensemble-refined carboxymyoglobin photolysis power titration, 6 mJ/cm2
Descriptor:	CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:	Barends, T, Schlichting, I.
Deposit date:	2023-11-29
Release date:	2024-01-31
Last modified:	2024-03-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Influence of pump laser fluence on ultrafast myoglobin structural dynamics. Nature, 626, 2024

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