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Structure paper

TitleSDCBP PanDDA analysis group deposition
Journal, issue, pagesTo Be Published
Publish dateJan 24, 2023 (structure data deposition date)
AuthorsBradshaw, W.J. / Katis, V.L. / Bountra, C. / von Delft, F. / Brennan, P.E.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.77 - 2.8 Å
Structure data

PDB-7fsg:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z56772132
Method: X-RAY DIFFRACTION / Resolution: 2.02 Å

PDB-7fsh:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z32367954
Method: X-RAY DIFFRACTION / Resolution: 2.11 Å

PDB-7fsi:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z18197050
Method: X-RAY DIFFRACTION / Resolution: 2.31 Å

PDB-7fsj:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z57744712
Method: X-RAY DIFFRACTION / Resolution: 1.97 Å

PDB-7fsk:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1954800564
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-7fsl:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z730649594
Method: X-RAY DIFFRACTION / Resolution: 2.38 Å

PDB-7fsm:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z763030030
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-7fsn:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z254580486
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-7fso:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z198195770
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-7fsp:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1650168321
Method: X-RAY DIFFRACTION / Resolution: 1.86 Å

PDB-7fsq:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1429867185
Method: X-RAY DIFFRACTION / Resolution: 2.07 Å

PDB-7fsr:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z54615640
Method: X-RAY DIFFRACTION / Resolution: 2.29 Å

PDB-7fss:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z839706072
Method: X-RAY DIFFRACTION / Resolution: 2.11 Å

PDB-7fst:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z26968795
Method: X-RAY DIFFRACTION / Resolution: 1.98 Å

PDB-7fsu:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z729726784
Method: X-RAY DIFFRACTION / Resolution: 1.97 Å

PDB-7fsv:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1454310449
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

PDB-7fsw:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z169675004
Method: X-RAY DIFFRACTION / Resolution: 2.14 Å

PDB-7fsx:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1328078283
Method: X-RAY DIFFRACTION / Resolution: 1.91 Å

PDB-7fsy:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1148165337
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-7fsz:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z3006151474
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-7ft0:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z56767614
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

PDB-7ft1:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z2204875953
Method: X-RAY DIFFRACTION / Resolution: 2.11 Å

PDB-7ft2:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z235449082
Method: X-RAY DIFFRACTION / Resolution: 2.04 Å

PDB-7ft3:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z291279160
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-7ft4:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z48847594
Method: X-RAY DIFFRACTION / Resolution: 2.17 Å

PDB-7ft5:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with POB0093
Method: X-RAY DIFFRACTION / Resolution: 1.77 Å

PDB-7ft6:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with POB0008
Method: X-RAY DIFFRACTION / Resolution: 1.85 Å

PDB-7ft7:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z57127349
Method: X-RAY DIFFRACTION / Resolution: 1.78 Å

PDB-7ft8:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with NCL-00024671
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-7ft9:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z45636695
Method: X-RAY DIFFRACTION / Resolution: 1.77 Å

PDB-7fta:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z228589380
Method: X-RAY DIFFRACTION / Resolution: 2.03 Å

PDB-7ftb:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1198269757
Method: X-RAY DIFFRACTION / Resolution: 2.22 Å

PDB-7ftc:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z1509711879
Method: X-RAY DIFFRACTION / Resolution: 1.87 Å

PDB-7ftd:
SDCBP PanDDA analysis group deposition -- The PDZ domans of SDCBP in complex with Z27782662
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-SO4:
SULFATE ION

ChemComp-DGL:
D-GLUTAMIC ACID

ChemComp-GLY:
GLYCINE

ChemComp-YG9:
(5R)-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione

ChemComp-ALA:
ALANINE

ChemComp-HOH:
WATER

ChemComp-UXA:
~{N}-cyclopropyl-1,3-benzodioxole-5-carboxamide

ChemComp-RZG:
methyl 4-sulfamoylbenzoate

ChemComp-YEB:
N,N-dimethylmorpholine-4-sulfonamide

ChemComp-NZ1:
5-methoxy-1,3-benzothiazol-2-amine

ChemComp-NUM:
N-[2-(4-hydroxyphenyl)ethyl]pyridine-2-carboxamide

ChemComp-WJA:
N-methyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide

ChemComp-YDG:
N,N-dimethyl-2-(1H-pyrazol-1-yl)acetamide

ChemComp-LJA:
N-[3-(carbamoylamino)phenyl]acetamide

ChemComp-VW7:
N-(8-methyl-1,2,3,4-tetrahydroquinolin-5-yl)acetamide

ChemComp-VVP:
4-methoxy-1H-indole

ChemComp-YFN:
N-[(3S)-3-methyl-1,1-dioxo-1lambda~6~-thiolan-3-yl]cyclopropanecarboxamide

ChemComp-2NU:
2-(4-bromanylpyrazol-1-yl)-~{N}-cyclopropyl-~{N}-methyl-ethanamide

ChemComp-Q6O:
N-(4-chloro-2,5-dimethoxyphenyl)acetamide

ChemComp-YDU:
2-cyclopentyl-N-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide

ChemComp-UQS:
N-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine

ChemComp-YDX:
N-(1-methyl-1H-pyrazol-3-yl)-2-(1H-pyrazol-1-yl)acetamide

ChemComp-I8A:
N-(cyclopropylmethyl)-2,2,3,3-tetramethylazetidine-1-carboxamide

ChemComp-YG5:
2-(1H-indazol-1-yl)-N,N-dimethylacetamide

ChemComp-LQ3:
(5S)-5-(difluoromethoxy)pyridin-2(5H)-one

ChemComp-RWP:
methyl 4-[(trifluoroacetyl)amino]benzoate

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-Q7L:
(3P)-3-(2H-1,3-benzodioxol-5-yl)-1H-pyrazole

ChemComp-JFS:
[4-(1H-benzimidazol-1-yl)phenyl]methanol

ChemComp-LV4:
1-[2-(trifluoromethyloxy)phenyl]thiourea

ChemComp-O0J:
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]acetamide

ChemComp-YEF:
4-(4-methoxyphenyl)oxane-4-carboxylic acid

ChemComp-YEK:
methyl 1-(methanesulfonyl)-2-methyl-D-prolinate

ChemComp-SZB:
succinimide

ChemComp-UU1:
2-(4-bromo-1H-pyrazol-1-yl)ethan-1-ol

ChemComp-4MB:
4-[(METHYLSULFONYL)AMINO]BENZOIC ACID

ChemComp-YER:
3-[(pyrimidin-2-yl)amino]benzoic acid

ChemComp-YEZ:
[1]benzofuro[2,3-d]pyridazin-4(3H)-one

ChemComp-YFR:
6-bromo-7-hydroxy-2,2-dimethyl-2H,4H-1,3-benzodioxin-4-one

ChemComp-YG0:
N-phenylcyclopropanecarboxamide

Source
  • homo sapiens (human)
KeywordsSIGNALING PROTEIN / Diamond I04-1 fragment screening / PanDDA / XChemExplorer

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