SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hww'

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.
1JFF_B_TA1B601_1
(TUBULIN BETA CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 1jffB-3hwwA:
undetectable		 1jffB-3hwwA:
21.43
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.
1MJ2_A_SAMA2200_0
(PROTEIN (METHIONINE
REPRESSOR))		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 HIS A 154
ALA A 155
GLY A 157
HIS A 132
PRO A 130
 None
None
NA  A 559 (-3.5A)
NA  A 566 (-4.9A)
None
 1.22A 1mj2A-3hwwA:
undetectable
1mj2B-3hwwA:
undetectable		 1mj2A-3hwwA:
11.01
1mj2B-3hwwA:
11.01
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.
1MJ2_C_SAMC2199_0
(PROTEIN (METHIONINE
REPRESSOR))		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 HIS A 154
ALA A 155
GLY A 157
HIS A 132
PRO A 130
 None
None
NA  A 559 (-3.5A)
NA  A 566 (-4.9A)
None
 1.28A 1mj2C-3hwwA:
undetectable
1mj2D-3hwwA:
undetectable		 1mj2C-3hwwA:
11.01
1mj2D-3hwwA:
11.01
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.
1MJL_A_SAMA200_0
(METHIONINE REPRESSOR
PROTEIN METJ)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 ALA A 438
ARG A 430
LEU A  61
ALA A 451
LEU A 455
 None
 1.16A 1mjlA-3hwwA:
undetectable
1mjlB-3hwwA:
undetectable		 1mjlA-3hwwA:
11.01
1mjlB-3hwwA:
11.01
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.
1MJO_C_SAMC200_0
(METHIONINE REPRESSOR)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 HIS A 154
ALA A 155
GLY A 157
HIS A 132
PRO A 130
 None
None
NA  A 559 (-3.5A)
NA  A 566 (-4.9A)
None
 1.24A 1mjoC-3hwwA:
undetectable
1mjoD-3hwwA:
undetectable		 1mjoC-3hwwA:
11.01
1mjoD-3hwwA:
11.01
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.
1MJQ_A_SAMA200_0
(METHIONINE REPRESSOR)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 HIS A 132
PRO A 130
HIS A 154
ALA A 155
GLY A 157
 NA  A 566 (-4.9A)
None
None
None
NA  A 559 (-3.5A)
 1.29A 1mjqA-3hwwA:
undetectable
1mjqB-3hwwA:
undetectable		 1mjqA-3hwwA:
11.01
1mjqB-3hwwA:
11.01
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.
1MJQ_I_SAMI199_0
(METHIONINE REPRESSOR)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 HIS A 132
PRO A 130
HIS A 154
ALA A 155
GLY A 157
 NA  A 566 (-4.9A)
None
None
None
NA  A 559 (-3.5A)
 1.27A 1mjqI-3hwwA:
undetectable
1mjqJ-3hwwA:
undetectable		 1mjqI-3hwwA:
11.01
1mjqJ-3hwwA:
11.01
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.
2BXQ_A_IMNA2001_1
(SERUM ALBUMIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 10 PHE A 170
TRP A  10
ALA A  11
LEU A  15
LEU A  37
 None
 0.98A 2bxqA-3hwwA:
undetectable		 2bxqA-3hwwA:
22.53
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.
2F16_H_BO2H1400_1
(PROTEASOME COMPONENT
PUP1
PROTEASOME COMPONENT
PUP3)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 ALA A  62
ALA A 161
GLY A  97
THR A  96
ALA A  93
 None
 1.11A 2f16H-3hwwA:
undetectable
2f16I-3hwwA:
undetectable		 2f16H-3hwwA:
18.11
2f16I-3hwwA:
17.78
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.
2F16_V_BO2V1401_1
(PROTEASOME COMPONENT
PUP1
PROTEASOME COMPONENT
PUP3)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 ALA A  62
ALA A 161
GLY A  97
THR A  96
ALA A  93
 None
 1.12A 2f16V-3hwwA:
undetectable
2f16W-3hwwA:
undetectable		 2f16V-3hwwA:
18.11
2f16W-3hwwA:
17.78
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.
2HXF_B_TA1B601_1
(TUBULIN BETA CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 2hxfB-3hwwA:
undetectable		 2hxfB-3hwwA:
21.43
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.
2HXH_B_TA1B601_1
(TUBULIN BETA CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 2hxhB-3hwwA:
undetectable		 2hxhB-3hwwA:
21.43
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.
2JFA_B_CCSB417_0
(ESTROGEN RECEPTOR)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 GLN A 255
LYS A 235
VAL A 237
 None
 0.89A 2jfaB-3hwwA:
undetectable		 2jfaB-3hwwA:
20.76
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.
2P4N_B_TA1B601_1
(TUBULIN BETA CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 2p4nB-3hwwA:
undetectable		 2p4nB-3hwwA:
21.43
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.
2VCV_B_ASDB1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 6 LEU A 549
ALA A 399
LEU A 396
ALA A 373
 None
NA  A 574 (-3.6A)
None
None
 0.99A 2vcvB-3hwwA:
undetectable		 2vcvB-3hwwA:
16.84
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.
2VCV_K_ASDK1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 6 LEU A 549
ALA A 399
LEU A 396
ALA A 373
 None
NA  A 574 (-3.6A)
None
None
 0.99A 2vcvK-3hwwA:
undetectable		 2vcvK-3hwwA:
16.84
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.
2WBE_B_TA1B1439_1
(TUBULIN BETA-2B
CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 2wbeB-3hwwA:
undetectable		 2wbeB-3hwwA:
21.43
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.
3BA0_A_HAEA477_1
(MACROPHAGE
METALLOELASTASE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 HIS A 496
GLU A 498
HIS A 499
 None
 0.71A 3ba0A-3hwwA:
undetectable		 3ba0A-3hwwA:
18.77
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.
3CV9_A_VDXA501_1
(CYTOCHROME P450-SU1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 9 THR A 256
VAL A 409
LEU A 380
ILE A 376
GLY A 227
 None
 1.27A 3cv9A-3hwwA:
undetectable		 3cv9A-3hwwA:
22.32
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.
3DCO_B_TA1B601_1
(BOVINE BETA TUBULIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 3dcoB-3hwwA:
undetectable		 3dcoB-3hwwA:
21.43
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.
3EDL_B_TA1B601_1
(BETA TUBULIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 3edlB-3hwwA:
undetectable		 3edlB-3hwwA:
21.43
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.
3IJD_B_C2FB314_0
(UNCHARACTERIZED
PROTEIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 LEU A  58
GLY A 420
LEU A 421
ILE A  91
LEU A  86
 None
None
NA  A 576 (-4.9A)
None
None
 1.12A 3ijdB-3hwwA:
undetectable		 3ijdB-3hwwA:
19.72
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.
3IZ0_B_TA1B820_1
(BETA TUBULIN, CHAIN
B FROM PDB 1JFF)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.95A 3iz0B-3hwwA:
undetectable		 3iz0B-3hwwA:
21.43
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_SALB3008_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 7 HIS A 496
VAL A 495
VAL A 466
ALA A 445
 None
 0.79A 3kp6B-3hwwA:
undetectable		 3kp6B-3hwwA:
14.03
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.
3MG0_V_BO2V1401_1
(PROTEASOME COMPONENT
PUP1
PROTEASOME COMPONENT
PUP3)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 ALA A  62
ALA A 161
GLY A  97
THR A  96
ALA A  93
 None
 1.08A 3mg0V-3hwwA:
undetectable
3mg0W-3hwwA:
undetectable		 3mg0V-3hwwA:
18.11
3mg0W-3hwwA:
17.78
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.
3ROZ_A_NCAA266_0
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 6 LEU A  63
ALA A 415
LEU A  95
THR A  96
 None
 0.96A 3rozA-3hwwA:
undetectable		 3rozA-3hwwA:
19.60
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.
3TWP_B_SALB404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 7 ALA A 319
PRO A 318
TYR A 306
ARG A 325
 None
 1.12A 3twpB-3hwwA:
undetectable		 3twpB-3hwwA:
23.06
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.
3TWP_C_SALC404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 7 ALA A 319
PRO A 318
TYR A 306
ARG A 325
 None
 0.96A 3twpC-3hwwA:
undetectable		 3twpC-3hwwA:
23.06
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.
4JQ1_B_NPSB401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 8 VAL A 393
VAL A 467
ILE A 465
LEU A 386
 None
 0.93A 4jq1B-3hwwA:
undetectable		 4jq1B-3hwwA:
20.14
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.
4JTQ_A_FLPA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 10 VAL A 393
VAL A 467
ILE A 465
LEU A 403
LEU A 386
 None
None
None
NA  A 573 (-4.0A)
None
 1.02A 4jtqA-3hwwA:
undetectable		 4jtqA-3hwwA:
20.14
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.
4L1W_B_STRB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 6 VAL A 393
VAL A 467
ILE A 465
LEU A 386
 None
 0.79A 4l1wB-3hwwA:
undetectable		 4l1wB-3hwwA:
20.00
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.
4LU3_A_AZMA302_1
(CARBONIC ANHYDRASE
14)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 HIS A 165
VAL A 164
LEU A 156
LEU A 103
THR A 104
 None
 1.00A 4lu3A-3hwwA:
undetectable		 4lu3A-3hwwA:
20.51
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.
4MWR_A_ZMRA513_2
(NEURAMINIDASE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 5 LEU A 285
ASP A 310
ARG A 325
ILE A 327
 None
 1.48A 4mwrA-3hwwA:
undetectable		 4mwrA-3hwwA:
20.90
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.
4N09_C_ADNC401_1
(ADENOSINE KINASE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 LEU A 452
ASN A 412
ALA A 451
LEU A 455
GLY A 417
 None
None
None
None
GOL  A 577 (-3.3A)
 0.90A 4n09C-3hwwA:
undetectable		 4n09C-3hwwA:
20.63
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.
4XTA_B_DIFB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 8 ILE A 134
LEU A  90
LEU A 100
ILE A 101
 None
 0.99A 4xtaB-3hwwA:
undetectable		 4xtaB-3hwwA:
19.57
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.
5D4U_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN MJ0489)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 GLY A  97
LEU A  63
THR A  96
GLY A 414
GLY A 314
 None
 1.00A 5d4uA-3hwwA:
undetectable		 5d4uA-3hwwA:
17.09
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.
5HNW_B_TA1B902_1
(TUBULIN BETA-2B
CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.87A 5hnwB-3hwwA:
undetectable		 5hnwB-3hwwA:
21.98
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.
5HNY_B_TA1B601_1
(TUBULIN BETA-2B
CHAIN)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 12 VAL A 237
GLU A 233
LEU A 294
LEU A 289
THR A 290
 None
 0.92A 5hnyB-3hwwA:
undetectable		 5hnyB-3hwwA:
22.36
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.
5I1N_F_DVAF9_0
(D-VILLIN HEADPIECE
SUBDOMAIN
VILLIN-1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 ALA A  82
ASN A  85
LEU A  86
 NA  A 564 (-3.2A)
None
None
 0.47A 5i1nC-3hwwA:
undetectable		 5i1nC-3hwwA:
5.05
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.
5I1N_G_DVAG9_0
(D-VILLIN HEADPIECE
SUBDOMAIN
VILLIN-1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 ALA A  82
ASN A  85
LEU A  86
 NA  A 564 (-3.2A)
None
None
 0.33A 5i1nB-3hwwA:
undetectable		 5i1nB-3hwwA:
5.05
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.
5I1O_F_DVAF9_0
(D-VILLIN HEADPIECE
SUBDOMAIN
VILLIN-1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 ALA A  82
ASN A  85
LEU A  86
 NA  A 564 (-3.2A)
None
None
 0.41A 5i1oC-3hwwA:
undetectable		 5i1oC-3hwwA:
5.05
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.
5I1O_H_DVAH9_0
(D-VILLIN HEADPIECE
SUBDOMAIN
VILLIN-1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 ALA A  82
ASN A  85
LEU A  86
 NA  A 564 (-3.2A)
None
None
 0.36A 5i1oA-3hwwA:
undetectable		 5i1oA-3hwwA:
5.05
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.
5I1P_F_DVAF9_0
(D-VILLIN HEADPIECE
SUBDOMAIN
VILLIN-1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 ALA A  82
ASN A  85
LEU A  86
 NA  A 564 (-3.2A)
None
None
 0.38A 5i1pA-3hwwA:
undetectable		 5i1pA-3hwwA:
5.05
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.
5I1P_G_DVAG9_0
(D-VILLIN HEADPIECE
SUBDOMAIN
VILLIN-1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 ALA A  82
ASN A  85
LEU A  86
 NA  A 564 (-3.2A)
None
None
 0.40A 5i1pD-3hwwA:
undetectable		 5i1pD-3hwwA:
5.05
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.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 GLY A 441
ASP A 442
ASN A 494
 AKG  A 557 ( 3.1A)
MG  A 558 ( 2.9A)
None
 0.57A 5jglA-3hwwA:
undetectable		 5jglA-3hwwA:
20.14
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.
6HU9_E_PCFE202_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL
CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		4 / 8 GLN A 258
ILE A 349
VAL A 224
ASP A 398
 None
None
None
NA  A 574 (-3.8A)
 1.01A 6hu9a-3hwwA:
undetectable
6hu9e-3hwwA:
undetectable		 6hu9a-3hwwA:
20.85
6hu9e-3hwwA:
13.41
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.
6HWD_V_BO2V301_0
(PROTEASOME SUBUNIT
BETA TYPE-2)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		5 / 11 ALA A  62
ALA A 161
GLY A  97
THR A  96
ALA A  93
 None
 1.07A 6hwdV-3hwwA:
undetectable		 6hwdV-3hwwA:
8.81