Table S3.49. Fragment 49 interactions with Arg

Fragment 49
Listed below are the ligands in the PDB that contain the chemical fragment shown on the left and which interact via this fragment with the side chain of a Arg residue via hydrogen bonds.

The PDB codes are hyperlinked to a schematic LIGPLOT diagram in PDBsum.

Ligand Description


  1. Ligand: 4AA
4-chloro-3-hydroxyanthranilic acid
PDB codes: 1yfw, 1yfx.


  2. Ligand: 4MB
4-[(methylsulfonyl)amino]benzoic acid
PDB code: 2hds.


  3. Ligand: BE2
2-aminobenzoic acid
PDB codes: 1c0i, 1f8s, 2jb3, 2yr6.


  4. Ligand: BEZ
Benzoic acid
PDB codes: 1gyx, 1h4o, 1hd2, 1oc3, 1oni, 1s8f, 1tmx, 1ukb, 1urm, 1uuj, 1v1t, 1w9e, 1w9q, 2f78, 2f7a, 2o02, 2ql8, 2qmq, 2rhm, 2v2g, 2v32, 3ccf.


  5. Ligand: BM6
4-[2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-[1,3]dioxolan-2-yl]-benzoic acid
PDB codes: 1mvc, 1mzn.


  6. Ligand: DOB
2,4-dihydroxybenzoic acid
PDB code: 1dod.


  7. Ligand: IZF
Methyl 2-{[5-({3-chloro-4-[(5s)-1,1-dioxido-3-oxoisothiazolidin-5-yl]-n-(phenylsulfonyl)-l-
phenylalanyl}amino)pentyl]oxy}-6-hydroxybenzoate
PDB code: 2cni.


  8. Ligand: PAB
4-aminobenzoic acid
PDB codes: 1iut, 1iuu.


  9. Ligand: PHB
P-hydroxybenzoic acid
PDB codes: 1bgn, 1cc4, 1dob, 1doc, 1fw9, 1g1b, 1g81, 1iuw, 1iux, 1jd3, 1k0i, 1pbe, 1pdh, 1pxc, 1tt8, 1ykj.


  10. Ligand: R2C
5-methoxy-2-[(4-phenoxyphenyl)amino]benzoic acid
PDB code: 2prl.


  11. Ligand: SAL
2-hydroxybenzoic acid
PDB codes: 1fo4, 3bpx.


  12. Ligand: ST1
4-(acetylamino)-3-hydroxy-5-nitrobenzoic acid
PDB code: 1ivd.


  13. Ligand: UN7
3-[3-(3(s)-methylcarbamoyl-7-sulfoamino-3,4,-dihydro-1h-isoquinolin-2-yl)-3-oxo-propyl]-benzoic acid
PDB code: 2f71.


  14. Ligand: VNL
4-hydroxy-3-methoxybenzoate
PDB code: 1xlr.


  15. Ligand: BEZ
Benzoic acid
PDB codes: 1gyx, 1h4o, 1hd2, 1oc3, 1oni, 1s8f, 1tmx, 1ukb, 1urm, 1uuj, 1v1t, 1w9e, 1w9q, 2f78, 2f7a, 2o02, 2ql8, 2qmq, 2rhm, 2v2g, 2v32, 3ccf.


  16. Ligand: 201
3-amido-5-biphenyl-benzoic acid
PDB code: 2b0m.


  17. Ligand: 2PB
2-[(dioxidophosphino)oxy]benzoate
PDB code: 1sde.


  18. Ligand: 394
R-3-fluoro-4-[2-hydroxy-2-(5,5,8,8-tetramethyl-5,6,7,8,-tetrahydro-naphtalen-2-yl)-acetylamino]-
benzoic acid
PDB code: 1exa.


  19. Ligand: 3B4
2-(cyclohexylamino)benzoic acid
PDB code: 3b4p.


  20. Ligand: 5PH
5-[5-(1-carboxymethyl-2-oxo-propylcarbamoyl)-5-phenyl-pentylsulfamoyl]-2-hydroxy-benzoic acid
PDB code: 1rwv.


  21. Ligand: SAS
2-hydroxy-(5-([4-(2-pyridinylamino)sulfonyl]phenyl)azo)benzoic acid
PDB code: 13gs.


  22. Ligand: TTB
4-[(1e)-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-enyl]benzoic acid
PDB code: 1xap.