Ligand · TOE
TOE · 2-[2-(2-methoxy-ethoxy)-ethoxy]-ethoxyl
TOE, 2-[2-(2-methoxy-ethoxy)-ethoxy]-ethoxyl (C7 H16 O4, 164.2 g/mol), in the MolNFT structures on GenesisL1: bound in 28 records (22 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…
- Component
- TOE
- Formula
- C7 H16 O4
- Class
- ligand
- Structures
- 28
- PDB entries
- 22
Binding sites
TOE in 28 structures; the first of them:
- 5HXS · Structural mechanisms of extracellular ion exchange and induced binding-site occlusion in… · TOE A410 · binds TYR17, SER20, ASP21, MET215, LEU218, ALA219, LYS222
- 5ITO · Structure of the periplasmic binding protein M117N-NocT from A. tumefaciens in complex… · TOE A305 · binds PRO126, THR130
- 5JEI · Crystal structure of the GluA2 LBD in complex with FW · TOE A306 · binds PRO105, PHE106, SER108, ASN242, LEU247, ASP248, LYS251
- 5V4P · Saccharomyces cerevisiae OYE 3 soaked with p-hydroxybenzaldehyde · TOE A404 · binds TRP89, SER90, ASP91, HIS175, ASN179
- 6B4R · The crystal structure of the aldehyde dehydrogenase KauB from Pseudomonas aeruginosa · TOE A504 · binds ILE119, ASN168, PHE169, LEU172, MET173, TRP176, PHE296, VAL301 and 4 more
- 6FSD · Mus musculus acetylcholinesterase in complex with… · TOE A602 · binds VAL330, TYR428, ILE429, TYR510, LEU524, ARG525
- 6JU0 · Mouse antibody 3.3 Fab in complex with PEG · TOE H302 · binds TRP33, ARG52, TYR61, TYR32, TRP91, SER92, TYR94
- 6TCY · X-ray structure of Danio rerio histone deacetylase 6 (HDAC6) CD2 in complex with a… · TOE AAA910 · binds ASN457, ASP460, HIS463, SER531, ILE532, PHE533, PHE583
- 7LQD · Structure of Human MPS1 (TTK) covalently bound to RMS-07 inhibitor · TOE A907 · binds SER533, GLY534, HIS645, ASP647, LYS649, ASN652, ASP664, GLY666 and 2 more
- 7R3C · VX-inhibited acetylcholinesterase in complex with… · TOE A608 · binds ASP333, GLU351, ARG395, ASP396, LEU441, TRP442
- 8RYO · Structure of S2-198 TCR in complex with HLA-A*03:01 bound to ELFSYLIEK peptide · TOE A301 · binds GLN115, LYS121, ASP122, LYS58, ASP59, TRP60
- 8U2M · Structure of P450Blt from Micromonospora sp. MW-13 in Complex with Biarylitide · TOE B402 · binds THR109, GLN112, GLN113, ALA116, ILE117, GLN120, ARG145, ALA149
- 8Z30 · Crystal structure of HOIP PUB domain in complex with tolfenamic acid complex · TOE C201 · binds ARG58, ARG106, ASP110, ALA111, VAL112, GLN113, ARG116
- 5V4P · Saccharomyces cerevisiae oye 3 soaked with P-hydroxybenzaldehyde · TOE A404 · binds TRP89, SER90, ASP91, HIS175, ASN179
- 6B4R · The crystal structure of the aldehyde dehydrogenase kaub from pseudomonas aeruginosa · TOE A504 · binds ILE119, ASN168, PHE169, MET173, TRP176, CSD302, THR303, ASP459 and 1 more
- 6BZP · Stggyg from low-complexity domain of fus, residues 77-82 · TOE B101 · binds GLY3, GLY4, TYR5
- 6EX7 · Crystal structure of ndm-1 metallo-beta-lactamase in complex with CD ions and a… · TOE B306 · binds ARG45, GLY47, ASP48
- 6FSD · Mus musculus acetylcholinesterase in complex with 2-(4-biphenylyloxy)… · TOE A602 · binds VAL330, TYR428, ILE429, TYR510, LEU524, ARG525
- 6JU0 · Mouse antibody 3.3 Fab in complex with peg · TOE H302 · binds TRP33, ARG52, TYR61, TYR32, TRP91, SER92, TYR94
- 7LQD · Structure of human MPS1 (ttk) covalently bound to rms-07 inhibitor · TOE A907 · binds SER533, GLY534, HIS645, ASP647, LYS649, ASN652, ASP664, GLY666 and 2 more
- 7NJC · Crystal structure of the toxoplasma CPSF4 yth-domain in complex with a 7 mer M6A-modified… · TOE A600 · binds LYS446, HIS487, SER573, CYS576
Residues it binds most
ASP 33, TYR 19, ALA 20, ARG 22, TRP 21, ASN 16, LYS 17, SER 17, PHE 8, HIS 15 (residue and the binding sites it lines).
Found with
- EDO · 1,2-ethanediol
- PG0 · 2-(2-methoxyethoxy)ethanol
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
- P15 · 2,5,8,11,14,17-hexaoxanonadecan-19-ol
- GOL · Glycerol
- PG4 · Tetraethylene glycol
- I1X · 4-methyl-3-nitro-~{N}-[(2~{E},4~{E})-5-[2-[(oxidanylamino)methyl]pyridin-1-yl]penta-2,4-dienyl]benzamide
- NA · Sodium ion
- K · Potassium ion
- CL · Chloride ion
- 1PE · Pentaethylene glycol
- PEG · Di(hydroxyethyl)ether
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