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Ligand · VLD

VLD · (2S)-2-({4-[({(6R)-2,4-diamino-5-[(1-{(2R,4S,5R)-4-hydroxy-5-[(phosphonooxy)methyl]tetrahydrofuran-2-yl}-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-d]pyrimidin-6-yl}methyl)amino]benzoyl}amino)pentanedioic acid (non-preferred name)

VLD, (2S)-2-({4-[({(6R)-2,4-diamino-5-[(1-{(2R,4S,5R)-4-hydroxy-5-[(phosphonooxy)methyl]tetrahydrofuran-2-yl}-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-d]pyrimidin-6-yl}methyl)amino]benzoyl}amino)pentan…

Component
VLD
Formula
C30 H38 N9 O13 P
Class
ligand
Structures
1
PDB entries
1

Binding sites

VLD in 1 structure; the first of them:

  • 7JX1 · E. coli TSase complex with a bi-substrate reaction intermediate analog · VLD B301 · binds ARG126, ARG21, HIS51, SER54, ILE79, TRP80, TRP83, TYR94 and 16 more

Residues it binds most

ARG 1, HIS 1, CYS 1, LEU 1, SER 1, TRP 1, TYR 1, ALA 1, ASN 1, ASP 1 (residue and the binding sites it lines).

Found with

  • TMP · Thymidine-5'-phosphate
  • VLA · N-(4-{[(2,4-diamino-7,8-dihydropyrido[3,2-d]pyrimidin-6-yl)methyl]amino}benzene-1-carbonyl)-L-glutamic acid
  • PO4 · Phosphate ion

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