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Ligand clusters for UniProt code P0AEK4

Ligand clusters for P0AEK4: Enoyl-[acyl-carrier-protein] reductase [NADH] FabI from Escherichia coli (strain K12)

1 ligand cluster


Cluster 1. 15 ligand types 36 ligands

Representative protein: 1mfpA

Structures

PDB		Schematic diagram

1mfpA
1qsgA
1qg6A
1dfiA
1c14A
		more ...

Cluster 1 contains 15 ligand types

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Ligand

Description

1. Ligand: NAD × 10

Nicotinamide-Adenine-Dinucleotide

PDB codes: 1c14(A), 1d8a(A), 1dfi(A), 1i2z(A), 1i30(A), 1lx6(A), 1lxc(A), 1mfp(A), 1qg6(A), 1qsg(A).

2. Ligand: TCL × 7

triclosan

Triclosan

PDB codes: 1c14(A), 1d8a(A), 1qg6(A), 1qsg(A), 3pjd(A), 3pje(A), 3pjf(A).

3. Ligand: GLC × 1

Alpha-D-Glucopyranose

PDB code: 1qsg(A).

4. Ligand: AYM × 1

3-(6-Aminopyridin-3-Yl)-N-Methyl-N-[(1-Methyl-1h-Indol- 2-Yl)methyl]acrylamide

PDB code: 1lxc(A).

5. Ligand: IDN × 1

(E)-N-Methyl-N-(1-Methyl-1h-Indol-3-Ylmethyl)-3-(7-Oxo- 5,6,7,8-Tetrahydro-[1,8]naphthyridin-3-Yl)-
Acrylamide

PDB code: 1mfp(A).

6. Ligand: 826 × 1

1,3,4,9-Tetrahydro-2-(Hydroxybenzoyl)-9-[(4- Hydroxyphenyl)methyl]-6-Methoxy-2h-Pyrido[3,4-B]indole

PDB code: 1i30(A).

7. Ligand: 654 × 1

4-(2-Thienyl)-1-(4-Methylbenzyl)-1h-Imidazole

PDB code: 1i2z(A).

8. Ligand: ZAM × 1

3-[(Acetyl-Methyl-Amino)-Methyl]-4-Amino-N-Methyl-N-(1- Methyl-1h-Indol-2-Ylmethyl)-Benzamide

PDB code: 1lx6(A).

9. Ligand: NAD × 6

Nicotinamide-Adenine-Dinucleotide

PDB codes: 3pjd(A), 3pje(A), 3pjf(A), 4jqc(A), 4jx8(A),

10. Ligand: AE6 × 2

6-{(1e)-3-[3-(3-Methyl-1-Benzofuran-2-Yl)azetidin-1- Yl]-3-Oxoprop-1-En-1-Yl}-1,8-Naphthyridin-
2(1h)-One

PDB codes: 4jx8(A),

11. Ligand: 0WE × 1

N-Methyl-N-[(3-Methyl-1-Benzofuran-2-Yl)methyl]-3-(7- Oxo-5,6,7,8-Tetrahydro-1,8-Naphthyridin-3-
Yl) propanamide

PDB code: 4jqc(A).

12. Ligand: NAD-BBN × 1

NAD=Nicotinamide-Adenine-Dinucleotide, BBN=1-Hydroxy-2,3,1-Benzodiazaborinine-2(1h)-Carboxamide.

PDB code: 5cg1(A).

13. Ligand: NAD-CJ3 × 1

NAD=Nicotinamide-Adenine-Dinucleotide, CJ3=1-Hydroxy-2,3,1-Benzodiazaborinine-2(1h)-Carbothioamide.

PDB code: 5cg2(A).

14. Ligand: NAD-NDT × 1

NAD=Nicotinamide-Adenine-Dinucleotide, NDT=2-(Toluene-4-Sulfonyl)-2h-Benzo[d][1,2,3]diazaborinin- 1-Ol.

PDB code: 1dfg(A).

15. Ligand: NAD-TDB × 1

NAD=Nicotinamide-Adenine-Dinucleotide, TDB=6-Methyl-2(propane-1-Sulfonyl)-2h-Thieno[3,2-D][1,2, 3]diazaborinin-1-Ol.

PDB code: 1dfh(A).