Hitting a moving target: simulation and crystallography study of ATAD2 bromodomain blockers
Sledz, P.To be published.
Experimental Data Snapshot
Entity ID: 1 | |||||
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Molecule | Chains | Sequence Length | Organism | Details | Image |
ATPase family AAA domain-containing protein 2 | 130 | Homo sapiens | Mutation(s): 0  Gene Names: ATAD2, L16, PRO2000 EC: 3.6.1.3 (PDB Primary Data), 3.6.1 (UniProt) | ||
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for Q6PL18 (Homo sapiens) Explore Q6PL18  Go to UniProtKB:  Q6PL18 | |||||
PHAROS:  Q6PL18 GTEx:  ENSG00000156802  | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | Q6PL18 | ||||
Sequence AnnotationsExpand | |||||
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Ligands 2 Unique | |||||
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ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
BQ8 Query on BQ8 | B [auth A], C [auth A] | (2~{R})-~{N}-[5-[3,5-bis(oxidanyl)phenyl]-4-ethanoyl-1,3-thiazol-2-yl]-2-carbamimidamido-propanamide C15 H17 N5 O4 S UGPBIUVAGLINNK-ZCFIWIBFSA-N | |||
SO4 Query on SO4 | D [auth A] | SULFATE ION O4 S QAOWNCQODCNURD-UHFFFAOYSA-L |
Length ( ? ) | Angle ( ? ) |
---|---|
a = 79.072 | ¦Á = 90 |
b = 79.072 | ¦Â = 90 |
c = 139.764 | ¦Ă = 120 |
Software Name | Purpose |
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PHENIX | refinement |
XDS | data reduction |
PHASER | phasing |