SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4gcm'

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.
1EKJ_G_ACTG3009_0
(BETA-CARBONIC
ANHYDRASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 5 GLY A 160
LEU A 163
THR A 164
VAL A 149
 None
 0.71A 1ekjF-4gcmA:
undetectable
1ekjG-4gcmA:
undetectable		 1ekjF-4gcmA:
20.92
1ekjG-4gcmA:
20.92
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.
1IHI_A_IU5A326_1
(3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		5 / 10 VAL A 149
VAL A 170
ILE A 195
GLU A 158
LEU A 179
 None
 1.44A 1ihiA-4gcmA:
1.1		 1ihiA-4gcmA:
21.68
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.
1N49_B_RITB301_2
(PROTEASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		5 / 11 ALA A 104
VAL A  86
ILE A 272
ILE A  10
ILE A  95
 None
 0.95A 1n49B-4gcmA:
undetectable		 1n49B-4gcmA:
16.77
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.
1N49_D_RITD401_1
(PROTEASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		5 / 11 ALA A 104
VAL A  86
ILE A 272
ILE A  10
ILE A  95
 None
 0.95A 1n49C-4gcmA:
undetectable		 1n49C-4gcmA:
16.77
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.
1TH6_A_OINA401_1
(PHOSPHOLIPASE A2)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 GLY A 282
ASP A 280
TYR A 258
PRO A 242
 None
 1.11A 1th6A-4gcmA:
undetectable		 1th6A-4gcmA:
15.76
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.
2ARM_A_OINA401_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 GLY A 282
ASP A 280
TYR A 258
PRO A 242
 None
 1.10A 2armA-4gcmA:
undetectable		 2armA-4gcmA:
15.76
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.
2JKJ_A_CLMA1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 6 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.84A 2jkjA-4gcmA:
undetectable		 2jkjA-4gcmA:
20.45
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.
2JKJ_B_CLMB1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 6 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.84A 2jkjB-4gcmA:
undetectable		 2jkjB-4gcmA:
20.45
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.
2JKJ_C_CLMC1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 6 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.85A 2jkjC-4gcmA:
undetectable		 2jkjC-4gcmA:
20.45
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.
2JKJ_E_CLME1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.83A 2jkjE-4gcmA:
undetectable		 2jkjE-4gcmA:
20.45
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.
2JKL_A_CLMA1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.86A 2jklA-4gcmA:
undetectable		 2jklA-4gcmA:
20.45
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.
2JKL_D_CLMD1145_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.87A 2jklD-4gcmA:
undetectable		 2jklD-4gcmA:
20.45
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.
2JKL_F_CLMF1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 PRO A  39
GLY A  14
ILE A  10
GLY A  12
 None
FAD  A 401 (-3.4A)
None
FAD  A 401 (-3.2A)
 0.87A 2jklF-4gcmA:
undetectable		 2jklF-4gcmA:
20.45
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.
3FPJ_A_SAMA301_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		6 / 12 PHE A 273
ILE A 272
GLY A 271
VAL A 269
ALA A 106
VAL A  86
 None
 1.29A 3fpjA-4gcmA:
undetectable		 3fpjA-4gcmA:
23.28
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.
3IA4_A_MTXA164_2
(DIHYDROFOLATE
REDUCTASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 4 ILE A 109
PHE A 247
ILE A  11
THR A 267
 None
 1.11A 3ia4A-4gcmA:
undetectable		 3ia4A-4gcmA:
18.85
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.
3KP6_B_SALB3001_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 8 GLU A 101
LYS A 100
ASN A  99
ILE A  83
 None
None
None
FAD  A 401 (-4.4A)
 1.23A 3kp6A-4gcmA:
undetectable
3kp6B-4gcmA:
undetectable		 3kp6A-4gcmA:
21.50
3kp6B-4gcmA:
21.50
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.
4AC9_B_DXCB1473_0
(MJ0495-LIKE PROTEIN)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		5 / 11 ILE A 272
ILE A 252
GLY A 251
VAL A 278
ARG A  36
 None
None
None
None
FAD  A 401 (-3.6A)
 0.74A 4ac9B-4gcmA:
undetectable
4ac9C-4gcmA:
undetectable		 4ac9B-4gcmA:
22.73
4ac9C-4gcmA:
22.73
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.
4DF3_A_SAMA301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		5 / 12 GLY A  17
ALA A  21
ALA A 297
ASP A 292
ALA A 289
 None
None
None
None
FAD  A 401 (-3.5A)
 1.34A 4df3A-4gcmA:
4.0		 4df3A-4gcmA:
21.74
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.
4G19_D_ACTD305_0
(GLUTATHIONE
TRANSFERASE GTE1)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 4 ILE A 206
LEU A 203
LYS A 204
ASN A 207
 None
 1.49A 4g19D-4gcmA:
undetectable		 4g19D-4gcmA:
24.02
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.
4K7G_B_ACTB902_0
(3-HYDROXYPROLINE
DEHYDRATSE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 7 ASP A 223
SER A 225
HIS A 201
SER A 220
 None
 1.24A 4k7gB-4gcmA:
undetectable		 4k7gB-4gcmA:
22.39
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.
4XDT_A_ACTA409_0
(FAD:PROTEIN FMN
TRANSFERASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 5 ILE A  95
VAL A 107
ILE A 109
VAL A  86
 None
 0.64A 4xdtA-4gcmA:
undetectable		 4xdtA-4gcmA:
23.53
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.
4ZJZ_A_BEZA1001_0
(BENZOATE-COENZYME A
LIGASE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 8 ALA A 275
GLY A 293
ALA A  20
GLY A  17
 None
 0.67A 4zjzA-4gcmA:
undetectable		 4zjzA-4gcmA:
21.47
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.
5HES_A_032A401_2
(MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		4 / 6 LYS A 169
PHE A 197
SER A 215
VAL A 216
 None
 1.03A 5hesA-4gcmA:
undetectable		 5hesA-4gcmA:
20.12
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.
5I3C_B_AC2B301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 4gcm THIOREDOXIN
REDUCTASE
(Staphylococcus
aureus) 		5 / 10 GLY A 160
ALA A 181
VAL A 157
GLU A 158
ILE A 172
 None
 1.06A 5i3cB-4gcmA:
undetectable		 5i3cB-4gcmA:
25.62