SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4hgn'

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.
1AKD_A_CAMA420_0
(CYTOCHROME P450CAM)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		5 / 11 THR A  61
THR A  38
GLY A  20
THR A  25
VAL A  27
 None
None
MG  A 200 ( 4.3A)
None
None
 1.17A 1akdA-4hgnA:
undetectable		 1akdA-4hgnA:
17.15
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.
1BU5_A_RBFA301_1
(PROTEIN (FLAVODOXIN))		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ASN A  40
THR A  25
GLY A 146
ASP A 145
 None
 0.91A 1bu5A-4hgnA:
2.5		 1bu5A-4hgnA:
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.
2QEU_C_ACTC141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		3 / 3 VAL A 112
ASP A 111
GLU A 133
 None
 0.73A 2qeuC-4hgnA:
undetectable		 2qeuC-4hgnA:
23.08
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.
3BU1_A_HSMA301_1
(LIPOCALIN)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		4 / 7 SER A  84
VAL A 117
TYR A 107
ILE A  60
 None
 1.24A 3bu1A-4hgnA:
undetectable		 3bu1A-4hgnA:
18.89
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.
3CLB_A_TMQA611_1
(DHFR-TS)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		5 / 11 VAL A  21
ALA A 130
ILE A 141
ILE A   4
LEU A 106
 None
 1.02A 3clbA-4hgnA:
2.8		 3clbA-4hgnA:
15.11
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.
3HBB_A_TMQA611_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		5 / 10 VAL A  21
ALA A 130
ILE A 141
ILE A   4
LEU A 106
 None
 1.04A 3hbbA-4hgnA:
2.7		 3hbbA-4hgnA:
15.11
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.
3HBB_C_TMQC613_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		5 / 11 VAL A  21
ALA A 130
ILE A 141
ILE A   4
LEU A 106
 None
 1.09A 3hbbC-4hgnA:
undetectable		 3hbbC-4hgnA:
15.11
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.
3LXI_A_CAMA423_0
(CYTOCHROME P450)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		5 / 10 THR A  61
THR A  38
GLY A  20
THR A  25
VAL A  27
 None
None
MG  A 200 ( 4.3A)
None
None
 1.17A 3lxiA-4hgnA:
undetectable		 3lxiA-4hgnA:
18.23
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.
3LXI_B_CAMB423_0
(CYTOCHROME P450)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		5 / 11 THR A  61
THR A  38
GLY A  20
THR A  25
VAL A  27
 None
None
MG  A 200 ( 4.3A)
None
None
 1.14A 3lxiB-4hgnA:
undetectable		 3lxiB-4hgnA:
18.23
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.
3W1W_A_CHDA1504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		4 / 4 PRO A 124
LEU A 123
ILE A  11
ARG A  10
 None
 1.46A 3w1wA-4hgnA:
3.0		 3w1wA-4hgnA:
19.20
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.
5FUK_A_SNPA1236_1
(MROUPO)		 4hgn 2-KETO-3-DEOXY-D-MAN
NO-OCTULOSONATE
8-PHOSPHATE
PHOSPHOHYDROLASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ILE A  47
ILE A  59
PHE A  94
LEU A  75
 None
 0.79A 5fukA-4hgnA:
undetectable
5fukB-4hgnA:
undetectable		 5fukA-4hgnA:
20.90
5fukB-4hgnA:
20.90