SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4r0k'

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.
2J9C_A_ACTA1122_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 SER A  39
SER A 197
VAL A 130
LYS A 199
 None
 1.37A 2j9cA-4r0kA:
undetectable
2j9cB-4r0kA:
undetectable
2j9cC-4r0kA:
undetectable		 2j9cA-4r0kA:
18.18
2j9cB-4r0kA:
18.18
2j9cC-4r0kA:
18.18
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.
2Q6H_A_CXXA802_1
(TRANSPORTER)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 ILE A 234
ARG A 272
PHE A 285
PHE A 249
 None
 0.99A 2q6hA-4r0kA:
undetectable		 2q6hA-4r0kA:
20.74
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.
2Y7H_B_SAMB530_0
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 157
ASN A 322
THR A 319
ASN A 133
PHE A 212
 None
GOL  A 403 (-3.6A)
None
None
None
 0.92A 2y7hB-4r0kA:
undetectable		 2y7hB-4r0kA:
21.69
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.
3ATT_A_ACTA1209_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 4 ASP A 289
ARG A 272
ASP A 286
GLU A 288
 None
 1.28A 3attA-4r0kA:
0.0		 3attA-4r0kA:
21.56
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.
3AVP_A_MV2A313_1
(PANTOTHENATE KINASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 VAL A 130
LEU A  58
TYR A 112
ILE A 189
 None
 1.03A 3avpA-4r0kA:
undetectable		 3avpA-4r0kA:
22.16
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.
3GSS_A_EAAA212_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 VAL A 228
ILE A 216
THR A 319
GLY A 315
 None
None
None
GOL  A 403 ( 4.3A)
 0.72A 3gssA-4r0kA:
undetectable		 3gssA-4r0kA:
20.13
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.
3GSS_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 VAL A 228
ILE A 216
THR A 319
GLY A 315
 None
None
None
GOL  A 403 ( 4.3A)
 0.70A 3gssB-4r0kA:
undetectable		 3gssB-4r0kA:
20.13
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.
3L8L_C_DVAC6_0
(GRAMICIDIN D)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 ALA A 131
VAL A 107
TRP A 168
 None
 0.80A 3l8lC-4r0kA:
undetectable
3l8lD-4r0kA:
undetectable		 3l8lC-4r0kA:
4.42
3l8lD-4r0kA:
8.91
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.
3NXU_A_RITA600_1
(CYTOCHROME P450 3A4)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 211
ILE A 266
ALA A 183
ILE A 189
GLY A 195
 None
 1.07A 3nxuA-4r0kA:
undetectable		 3nxuA-4r0kA:
21.73
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.
4ARC_A_LEUA1001_0
(LEUCINE--TRNA LIGASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 191
ASP A 202
SER A 204
HIS A 263
 CSA  A 203 ( 4.5A)
EDO  A 404 (-2.9A)
EDO  A 404 (-3.1A)
CSA  A 203 ( 4.0A)
 1.32A 4arcA-4r0kA:
undetectable		 4arcA-4r0kA:
16.25
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.
4E7C_A_ACTA504_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 134
TRP A 100
GLY A  60
 None
 1.04A 4e7cA-4r0kA:
undetectable		 4e7cA-4r0kA:
19.39
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.
4ZBQ_A_ACTA605_0
(SERUM ALBUMIN)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 6 HIS A 263
GLY A 250
ARG A 299
ASN A 296
 CSA  A 203 ( 4.0A)
CL  A 401 ( 4.8A)
CL  A 401 (-4.4A)
CL  A 401 (-3.9A)
 1.36A 4zbqA-4r0kA:
undetectable		 4zbqA-4r0kA:
19.81
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.
5CU6_A_ACTA403_0
(CASEIN KINASE II
SUBUNIT ALPHA)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 6 ILE A 232
VAL A 247
ASP A 245
ALA A 303
 None
 0.74A 5cu6A-4r0kA:
undetectable		 5cu6A-4r0kA:
21.57
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.
5ESK_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 4 ALA A  32
PRO A  62
LEU A 326
HIS A 328
 None
 1.35A 5eskA-4r0kA:
undetectable		 5eskA-4r0kA:
19.71
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.
5IEN_A_VDYA201_2
(CDL2.2)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		5 / 12 VAL A 201
ILE A 274
LEU A 206
GLY A 205
TYR A 184
 None
None
CSA  A 203 ( 4.4A)
CSA  A 203 ( 4.5A)
None
 1.15A 5ienA-4r0kA:
undetectable		 5ienA-4r0kA:
19.81
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.
5Y9Y_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 169
PHE A 212
ARG A 134
 None
 1.03A 5y9yA-4r0kA:
undetectable		 5y9yA-4r0kA:
21.31
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.
6FGD_A_ACTA819_0
(GEPHYRIN)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 251
GLY A 260
GLU A 259
 None
 0.60A 6fgdA-4r0kA:
undetectable		 6fgdA-4r0kA:
22.00
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.
6FHW_A_ACRA801_2
(GLUCOAMYLASE P)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 TRP A 100
GLU A  99
GLU A 138
 None
 0.83A 6fhwA-4r0kA:
undetectable		 6fhwA-4r0kA:
14.84
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.
6G31_G_ZOLG401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		4 / 7 ASP A  79
GLN A  75
LYS A  64
TYR A 325
 GOL  A 403 (-3.5A)
None
None
None
 1.18A 6g31G-4r0kA:
undetectable		 6g31G-4r0kA:
14.01
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.
6JNH_A_ASCA202_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 ASN A 322
PRO A  77
GLN A  75
 GOL  A 403 (-3.6A)
EDO  A 406 ( 4.8A)
None
 0.71A 6jnhA-4r0kA:
undetectable		 6jnhA-4r0kA:
18.87
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.
6JOG_A_ASCA202_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 4r0k DIPEPTIDYL-PEPTIDASE
VI
(Bacteroides
thetaiotaomicron) 		3 / 3 ASN A 322
PRO A  77
GLN A  75
 GOL  A 403 (-3.6A)
EDO  A 406 ( 4.8A)
None
 0.72A 6jogA-4r0kA:
undetectable		 6jogA-4r0kA:
18.87