Ligand clusters for UniProt code P26839

Ligand clusters for P26839: Virginiamycin A acetyltransferase OS=Staphylococcus aureus GN=vat PE=1 SV=2

		Top 6 (of 20) ligand clusters Cluster 1. 6 ligand types 8 ligands Cluster 2. 6 ligand types 8 ligands Cluster 3. 2 ligand types 3 ligands Cluster 4. 2 ligand types 4 ligands Cluster 5. 2 ligand types 3 ligands Cluster 6. 1 ligand type 1 ligand
Representative protein: 4husA

Structures

PDB		Schematic diagram
4husA
4myoA
6x3cA
6x3jA
4hurA

Cluster 1 contains 6 ligand types

Use checkboxes to select ligands to display in RasMol, Jmol, or download as an SDF file. Selection shortcuts: select all/none invert selection.
Ligand		Description
		1. Ligand: PEG × 2 Di(hydroxyethyl)ether PDB codes: 4hus(A),
		2. Ligand: SXA × 2 Thioacetic acid s-{2-[3-(2-Hydroxy-3,3-Dimethyl-4- Phosphonooxy-Butyrylamino)-Propionylamino]- Ethyl} ester PDB codes: 6x3c(A), 6x3j(A).
		3. Ligand: ACO × 1 Acetyl coenzyme A PDB code: 4hur(A).
		4. Ligand: O7S × 1 (3r,4r,5e,10e,12e,14s,16r,26ar)-16-Fluoro-14-Hydroxy- 12-Methyl-3-(Propan-2-Yl)-4-(Prop-2-En-1-Yl)- 3,4,8,9, 14,15,16,17,24,25,26,26a-Dodecahydro-1h,7h,22h-21,18- (Azeno)pyrrolo[2,1- C][1,8,4, 19]dioxadiazacyclotetracosine-1,7,22-Trione PDB code: 6x3c(A).
		5. Ligand: O7V × 1 (2r)-2-[(3s,4r,5e,10e,12e,14s,16r,26ar)-16-Fluoro-14- Hydroxy-4,12-Dimethyl-1,7,22-Trioxo- 4,7,8,9,14,15,16, 17,24,25,26,26a-Dodecahydro-1h,3h,22h-21,18-(Azeno) pyrrolo[2,1- C][1,8,4,19]dioxadiazacyclotetracosin-3- Yl]propyl isoquinolin-3-Ylcarbamate PDB code: 6x3j(A).
		6. Ligand: VIR × 1 Virginiamycin m1 PDB code: 4hus(A).

Cluster 2 contains 6 ligand types

Selection shortcuts: select all/none invert selection.
Ligand		Description
		1. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 4hus(A),
		2. Ligand: SXA × 2 Thioacetic acid s-{2-[3-(2-Hydroxy-3,3-Dimethyl-4- Phosphonooxy-Butyrylamino)-Propionylamino]- Ethyl} ester PDB codes: 6x3c(A), 6x3j(A).
		3. Ligand: ACO × 1 Acetyl coenzyme A PDB code: 4hur(A).
		4. Ligand: O7S × 1 (3r,4r,5e,10e,12e,14s,16r,26ar)-16-Fluoro-14-Hydroxy- 12-Methyl-3-(Propan-2-Yl)-4-(Prop-2-En-1-Yl)- 3,4,8,9, 14,15,16,17,24,25,26,26a-Dodecahydro-1h,7h,22h-21,18- (Azeno)pyrrolo[2,1- C][1,8,4, 19]dioxadiazacyclotetracosine-1,7,22-Trione PDB code: 6x3c(A).
		5. Ligand: O7V × 1 (2r)-2-[(3s,4r,5e,10e,12e,14s,16r,26ar)-16-Fluoro-14- Hydroxy-4,12-Dimethyl-1,7,22-Trioxo- 4,7,8,9,14,15,16, 17,24,25,26,26a-Dodecahydro-1h,3h,22h-21,18-(Azeno) pyrrolo[2,1- C][1,8,4,19]dioxadiazacyclotetracosin-3- Yl]propyl isoquinolin-3-Ylcarbamate PDB code: 6x3j(A).
		6. Ligand: PGE × 1 Triethylene glycol PDB code: 4hus(A).

Cluster 3 contains 2 ligand types

Selection shortcuts: select all/none invert selection.
Ligand		Description
		1. Ligand: SO4 × 2 Sulfate ion PDB codes: 4hur(A), 4hus(A).
		2. Ligand: PO4 × 1 Phosphate ion PDB code: 6x3c(A).

Cluster 4 contains 2 ligand types

Selection shortcuts: select all/none invert selection.
Ligand		Description
		1. Ligand: SO4 × 3 Sulfate ion PDB codes: 4hur(A), 4hus(A), 6x3c(A).
		2. Ligand: EDO × 1 1,2-Ethanediol PDB code: 4hur(A).

Cluster 5 contains 2 ligand types

Selection shortcuts: select all/none invert selection.
Ligand		Description
		1. Ligand: EDO × 2 1,2-Ethanediol PDB codes: 4hur(A), 4hus(A).
		2. Ligand: SO4 × 1 Sulfate ion PDB code: 4hus(A).

Cluster 6 contains 1 ligand type

Selection shortcuts: select all/none invert selection.
Ligand		Description
		1. Ligand: PEG × 1 Di(hydroxyethyl)ether PDB code: 4hus(A).