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5NWH
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POTENT INHIBITORS OF NUDT5 SILENCE HORMONE SIGNALING IN BREAST CANCER
Descriptor:ADP-sugar pyrophosphatase, 7-[[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione
Authors:Carter, M., Stenmark, P.
Deposit date:2017-05-06
Release date:2018-04-04
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Targeted NUDT5 inhibitors block hormone signaling in breast cancer cells.
Nat Commun, 9, 2018
5NQR
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POTENT INHIBITORS OF NUDT5 SILENCE HORMONE SIGNALING IN BREAST CANCER
Descriptor:ADP-sugar pyrophosphatase, 8-(dimethylamino)-1,3-dimethyl-7-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]purine-2,6-dione
Authors:Carter, M., Stenmark, P.
Deposit date:2017-04-21
Release date:2018-01-31
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Targeted NUDT5 inhibitors block hormone signaling in breast cancer cells.
Nat Commun, 9, 2018
5WRN
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HUMAN THYMIDYLATE SYNTHASE COMPLEXED WITH DCMP
Descriptor:Thymidylate synthase, 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE
Authors:Chen, D., Nordlund, P.
Deposit date:2016-12-02
Release date:2016-12-14
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Human thymidylate synthase complexed with dCMP
To Be Published
5IW8
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 4 [5-(3-([1,1'-BIPHENYL]-3-YL)UREIDO)-2-HYDROXYBENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, 5-{[([1,1'-biphenyl]-3-yl)carbamoyl]amino}-2-hydroxybenzoic acid, SODIUM ION, ...
Authors:Brunner, K., Schnell, R., Schneider, G.
Deposit date:2016-03-22
Release date:2016-08-17
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5IWC
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 3 [4-(3-([1,1'-BIPHENYL]-3-YL)UREIDO)-2-HYDROXYBENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, PYRIDOXAL-5'-PHOSPHATE, 4-{[([1,1'-biphenyl]-3-yl)carbamoyl]amino}-2-hydroxybenzoic acid
Authors:Schnell, R., Maric, S., Lindqvist, Y., Schneider, G.
Deposit date:2016-03-22
Release date:2016-08-17
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5I7O
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 7 [3-(3-(4-CHLOROPHENYL)UREIDO)BENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, PYRIDOXAL-5'-PHOSPHATE, 3-{[(4-chlorophenyl)carbamoyl]amino}benzoic acid
Authors:Schnell, R., Maric, S., Schneider, G.
Deposit date:2016-02-18
Release date:2016-08-17
Method:X-RAY DIFFRACTION (2.49 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5I7R
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 2 [3-(3-([1,1'-BIPHENYL]-3-YL)UREIDO)BENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, PYRIDOXAL-5'-PHOSPHATE, 3-{[([1,1'-biphenyl]-3-yl)carbamoyl]amino}benzoic acid, ...
Authors:Schnell, R., Maric, S., Schneider, G.
Deposit date:2016-02-18
Release date:2016-08-17
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5I7A
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 1 [3-(3-(3,4-DICHLOROPHENYL)UREIDO)BENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, 3-{[(3,4-dichlorophenyl)carbamoyl]amino}benzoic acid, PYRIDOXAL-5'-PHOSPHATE
Authors:Schnell, R., Maric, S., Schneider, G.
Deposit date:2016-02-17
Release date:2016-08-17
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5I7H
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 6 [3-(3-(4-BROMOPHENYL)UREIDO)BENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, 3-{[(4-bromophenyl)carbamoyl]amino}benzoic acid, PYRIDOXAL-5'-PHOSPHATE, ...
Authors:Schnell, R., Maric, S., Schneider, G.
Deposit date:2016-02-17
Release date:2016-08-17
Method:X-RAY DIFFRACTION (2.57 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5I6D
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MYCOBACTERIUM TUBERCULOSIS CYSM IN COMPLEX WITH THE UREA-SCAFFOLD INHIBITOR 5 [3-(3-(P-TOLYL)UREIDO) BENZOIC ACID]
Descriptor:O-phosphoserine sulfhydrylase, PYRIDOXAL-5'-PHOSPHATE, 3-{[(4-methylphenyl)carbamoyl]amino}benzoic acid, ...
Authors:Schnell, R., Maric, S., Schneider, G.
Deposit date:2016-02-16
Release date:2016-08-17
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Inhibitors of the Cysteine Synthase CysM with Antibacterial Potency against Dormant Mycobacterium tuberculosis.
J.Med.Chem., 59, 2016
5HS3
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HUMAN THYMIDYLATE SYNTHASE COMPLEXED WITH DUMP AND 3-AMINO-2-BENZOYL-4-METHYLTHIENO[2,3-B]PYRIDIN-6-OL
Descriptor:Thymidylate synthase, 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 3-amino-2-benzoyl-4-methylthieno[2,3-b]pyridin-6-ol
Authors:Chen, D., Almqvist, H., Axelsson, H., Jafari, R., Mateus, A., Haraldsson, M., Larsson, A., Artursson, P., Molina, D.M., Lundback, T., Nordlund, P.
Deposit date:2016-01-25
Release date:2016-02-24
Last modified:2016-04-06
Method:X-RAY DIFFRACTION (3.103 Å)
Cite:CETSA screening identifies known and novel thymidylate synthase inhibitors and slow intracellular activation of 5-fluorouracil
Nat Commun, 7, 2016