2026-08-29_00000260|ligand|9XZ8

Mycobacterium tuberculosis Anthranilate phosphoribosyltransferase in complex with bi-substrate inhibitor 301f; X-ray diffraction 1.60Å

Protein #1 378 residues (92% resolved)

Raw Sequence ...

MALSAEGSSGGSRGGSPKAEAASVPSWPQILGRLTDNRDLARGQAAWAMDQIMTGNARPAQIAAFAVAMTMKAPTADEVGELAGVMLSHAHPLPADTVPDDAVDVVGTGGDGVNTVNLSTMAAIVVAAAGVPVVKHGNRAASSLSGGADTLEALGVRIDLGPDLVARSLAEVGIGFCFAPRFHPSYRHAAAVRREIGVPTVFNLLGPLTNPARPRAGLIGCAFADLAEVMAGVFAARRSSVLVVHGDDGLDELTTTTTSTIWRVAAGSVDKLTFDPAGFGFARAQLDQLAGGDAQANAAAVRAVLGGARGPVRDAVVLNAAGAIVAHAGLSSRAEWLPAWEEGLRRASAAIDTGAAEQLLARWVRFGRQILEHHHHHH

Canonical Sequence ...

Non polymer #2 A1CRG

InChI=1S/C13H18NO7P/c15-12-7-14(6-10(12)8-21-22(18,19)20)5-9-3-1-2-4-11(9)13(16)17/h1-4,10,12,15H,5-8H2,(H,16,17)(H2,18,19,20)/t10-,12+/m1/s1

SMILES: c1ccc(c(c1)CN2C[C@@H]([C@H](C2)O)COP(=O)(O)O)C(=O)O

c1ccc(c(c1)CN2C[C@@H]([C@H](C2)O)COP(=O)(O)O)C(=O)O

Non polymer #3 CL

InChI=1S/ClH/h1H/p-1

SMILES: [Cl-]

[Cl-]

Non polymer #4 EDO

InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2

SMILES: C(CO)O

C(CO)O

Non polymer #5 IMD

InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)/p+1

SMILES: c1c[nH+]c[nH]1

c1c[nH+]c[nH]1

Non polymer #6 MG

InChI=1S/Mg/q+2

SMILES: [Mg+2]

[Mg+2]

Non polymer #7 PEG

InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

SMILES: C(COCCO)O

C(COCCO)O

Non polymer #8 PPV

InChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)

SMILES: OP(=O)(O)OP(=O)(O)O

OP(=O)(O)OP(=O)(O)O

Biounit #1 homo-dimer

Reference