SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1wa3'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)		 1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE
(Thermotoga
maritima) 		4 / 7 LEU A  16
THR A  42
GLY A  66
LEU A  55
 None
 0.94A 1gtiB-1wa3A:
undetectable		 1gtiB-1wa3A:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2YQZ_B_SAMB401_0
(HYPOTHETICAL PROTEIN
TTHA0223)		 1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE
(Thermotoga
maritima) 		6 / 12 GLY A  66
ILE A  64
LEU A  16
ALA A  48
ALA A  24
LEU A  55
 None
 1.43A 2yqzB-1wa3A:
undetectable		 2yqzB-1wa3A:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DC3_B_2FAB401_2
(ADENOSINE KINASE)		 1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE
(Thermotoga
maritima) 		4 / 5 LEU A  38
ILE A 127
ALA A 174
MET A 108
 None
 1.03A 4dc3B-1wa3A:
2.2		 4dc3B-1wa3A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R20_B_AERB602_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE
(Thermotoga
maritima) 		5 / 9 ALA A  48
PHE A  43
VAL A 105
GLY A  66
VAL A  80
 None
 1.25A 4r20B-1wa3A:
undetectable		 4r20B-1wa3A:
15.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AJQ_A_DB8A800_2
(SERINE/THREONINE-PRO
TEIN KINASE 10)		 1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE
(Thermotoga
maritima) 		4 / 4 VAL A 172
ILE A 200
ASN A 163
VAL A 177
 None
 1.30A 5ajqA-1wa3A:
undetectable		 5ajqA-1wa3A:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HLP_A_GAWA1501_0
(SUBSTANCE-P
RECEPTOR,SUBSTANCE-P
RECEPTOR)		 1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE
(Thermotoga
maritima) 		5 / 12 ILE A  87
VAL A  70
THR A  71
ILE A  96
HIS A  91
 None
 1.18A 6hlpA-1wa3A:
3.4		 6hlpA-1wa3A:
15.58