SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2iht'

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.
11GS_A_EAAA211_1
(GLUTATHIONE
S-TRANSFERASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 7 TYR A 561
PHE A 412
ILE A 460
GLY A 411
 TPP  A 600 ( 4.2A)
None
None
TPP  A 600 (-3.6A)
 0.88A 11gsA-2ihtA:
undetectable		 11gsA-2ihtA:
17.49
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.
1HSH_A_MK1A401_1
(HIV-II PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		6 / 12 GLY A 462
ALA A 461
ASP A 409
VAL A 407
ILE A 388
ILE A 555
 TPP  A 600 (-3.4A)
None
None
None
None
None
 1.32A 1hshA-2ihtA:
undetectable		 1hshA-2ihtA:
10.99
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.
2DTJ_B_THRB402_0
(ASPARTOKINASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 9 ASN A 469
ILE A 476
ASP A 472
GLY A 441
THR A 475
 None
 1.28A 2dtjA-2ihtA:
undetectable
2dtjB-2ihtA:
undetectable		 2dtjA-2ihtA:
15.53
2dtjB-2ihtA:
15.53
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.
2DU8_A_BEZA352_0
(D-AMINO-ACID OXIDASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 LEU A 498
TYR A 499
ILE A 502
GLY A 270
 None
 0.71A 2du8A-2ihtA:
undetectable		 2du8A-2ihtA:
21.77
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.
2DU8_B_BEZB1352_0
(D-AMINO-ACID OXIDASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 LEU A 498
TYR A 499
ILE A 502
GLY A 270
 None
 0.77A 2du8B-2ihtA:
undetectable		 2du8B-2ihtA:
21.77
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.
2GSS_A_EAAA0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 8 TYR A 561
PHE A 412
ILE A 460
GLY A 411
 TPP  A 600 ( 4.2A)
None
None
TPP  A 600 (-3.6A)
 0.92A 2gssA-2ihtA:
undetectable		 2gssA-2ihtA:
17.35
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.
2GSS_B_EAAB0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 8 TYR A 561
PHE A 412
ILE A 460
GLY A 411
 TPP  A 600 ( 4.2A)
None
None
TPP  A 600 (-3.6A)
 0.92A 2gssB-2ihtA:
undetectable		 2gssB-2ihtA:
17.35
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.
2NMZ_B_ROCB401_2
(PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.78A 2nmzA-2ihtA:
undetectable		 2nmzA-2ihtA:
10.60
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.
2NNK_A_ROCA401_2
(PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.80A 2nnkA-2ihtA:
undetectable		 2nnkA-2ihtA:
10.60
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.
2O4L_A_TPVA403_2
(PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		6 / 12 LEU A 239
VAL A 233
ILE A 228
GLY A 224
VAL A 343
ILE A 236
 None
 1.46A 2o4lB-2ihtA:
undetectable		 2o4lB-2ihtA:
10.60
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.
2V3K_A_SAMA1254_0
(ESSENTIAL FOR
MITOTIC GROWTH 1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 10 VAL A 487
GLY A 462
ASP A 409
LEU A 473
SER A 471
 None
TPP  A 600 (-3.4A)
None
None
None
 0.90A 2v3kA-2ihtA:
undetectable		 2v3kA-2ihtA:
21.86
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.
2V95_A_HCYA1375_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 ALA A  68
PRO A 101
VAL A 102
PHE A  58
ASP A  98
 None
 1.35A 2v95A-2ihtA:
undetectable		 2v95A-2ihtA:
19.83
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.
2XRZ_B_ACTB1463_0
(DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 7 VAL A 294
ILE A 236
ALA A 232
VAL A 339
GLY A 224
 None
 1.12A 2xrzB-2ihtA:
undetectable		 2xrzB-2ihtA:
22.29
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.
3AX9_B_SALB1340_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 8 LEU A  88
THR A  54
ALA A  64
ALA A  63
 None
 0.85A 3ax9B-2ihtA:
undetectable		 3ax9B-2ihtA:
18.97
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.
3AXZ_A_ADNA401_1
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 SER A 470
GLY A 439
GLY A 465
ILE A 476
GLY A 441
 None
None
TPP  A 600 (-3.5A)
None
None
 0.93A 3axzA-2ihtA:
undetectable		 3axzA-2ihtA:
18.71
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.
3EQM_A_ASDA601_1
(CYTOCHROME P450 19A1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 10 ILE A 388
ILE A 406
VAL A 488
MET A 382
LEU A 539
 None
 1.45A 3eqmA-2ihtA:
0.0		 3eqmA-2ihtA:
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.
3JWQ_B_VIAB901_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
CATALYTIC DOMAIN,
CONE CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
SUBUNIT ALPHA
CHIMERA)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 HIS A  25
ASN A 185
ALA A  76
VAL A 149
LEU A 168
 None
 1.47A 3jwqB-2ihtA:
undetectable
3jwqC-2ihtA:
undetectable		 3jwqB-2ihtA:
20.34
3jwqC-2ihtA:
20.34
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.
3K4V_B_ROCB201_2
(HIV-1 PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.84A 3k4vA-2ihtA:
undetectable		 3k4vA-2ihtA:
9.95
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.
3K4V_D_ROCD201_4
(HIV-1 PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.83A 3k4vD-2ihtA:
undetectable		 3k4vD-2ihtA:
11.43
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.
3N9J_A_EAAA210_1
(GLUTATHIONE
S-TRANSFERASE P)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 8 TYR A 561
PHE A 412
ILE A 460
GLY A 411
 TPP  A 600 ( 4.2A)
None
None
TPP  A 600 (-3.6A)
 0.91A 3n9jA-2ihtA:
undetectable		 3n9jA-2ihtA:
17.49
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.
3NDU_D_ROCD100_3
(PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.87A 3nduD-2ihtA:
undetectable		 3nduD-2ihtA:
9.95
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.
3PWR_A_ROCA401_2
(PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.81A 3pwrA-2ihtA:
undetectable		 3pwrA-2ihtA:
11.63
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.
3ROZ_A_NCAA266_0
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 LEU A 473
ALA A 461
ASP A 409
THR A 485
 None
 1.08A 3rozA-2ihtA:
undetectable		 3rozA-2ihtA:
18.34
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.
3TL9_A_ROCA401_2
(PROTEASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 ARG A 229
VAL A  62
THR A  94
 None
 0.82A 3tl9A-2ihtA:
undetectable		 3tl9A-2ihtA:
11.07
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.
3WIP_G_ACHG301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 8 THR A 146
TYR A 135
ARG A  21
LEU A  22
 None
 0.97A 3wipG-2ihtA:
undetectable
3wipH-2ihtA:
undetectable		 3wipG-2ihtA:
19.09
3wipH-2ihtA:
19.09
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 ASP A 409
GLY A 462
GLY A 464
ILE A 410
GLU A 556
 None
TPP  A 600 (-3.4A)
TPP  A 600 (-3.5A)
TPP  A 600 (-4.5A)
None
 1.12A 4dcmA-2ihtA:
undetectable		 4dcmA-2ihtA:
20.97
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.
4MM4_A_8PRA603_1
(TRANSPORTER)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		6 / 12 ASP A 409
VAL A  62
ALA A  63
PHE A  58
ASP A  98
THR A  94
 None
 1.18A 4mm4A-2ihtA:
undetectable		 4mm4A-2ihtA:
22.89
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.
4MM4_B_8PRB603_1
(TRANSPORTER)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 ASP A 409
VAL A  62
ALA A  63
PHE A  58
THR A  94
 None
 1.12A 4mm4B-2ihtA:
undetectable		 4mm4B-2ihtA:
22.89
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.
4MM7_A_29JA603_1
(TRANSPORTER)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 10 ASP A 409
VAL A  62
PHE A  58
ASP A  98
THR A  94
 None
 1.20A 4mm7A-2ihtA:
undetectable		 4mm7A-2ihtA:
22.89
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.
4MM8_A_RFXA603_1
(TRANSPORTER)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		6 / 12 ASP A 409
VAL A  62
ALA A  63
PHE A  58
ASP A  98
THR A  94
 None
 1.21A 4mm8A-2ihtA:
undetectable		 4mm8A-2ihtA:
22.89
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.
4PEV_C_ADNC501_2
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 PRO A 558
VAL A 384
HIS A 385
 None
None
GOL  A 604 (-4.3A)
 0.73A 4pevC-2ihtA:
3.9		 4pevC-2ihtA:
23.61
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.
4QTU_B_SAMB301_0
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 GLY A 441
ILE A 410
SER A 437
ILE A 446
ALA A 444
 None
TPP  A 600 (-4.5A)
TPP  A 600 (-3.5A)
None
None
 1.12A 4qtuB-2ihtA:
undetectable		 4qtuB-2ihtA:
15.88
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.
4QTU_D_SAMD301_0
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 GLY A 441
ILE A 410
SER A 437
ILE A 446
ALA A 444
 None
TPP  A 600 (-4.5A)
TPP  A 600 (-3.5A)
None
None
 1.08A 4qtuD-2ihtA:
undetectable		 4qtuD-2ihtA:
15.88
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.
4V1F_B_BQ1B1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 8 ALA A 240
ILE A 245
ALA A 351
PHE A 353
LEU A 213
 None
 1.33A 4v1fA-2ihtA:
undetectable
4v1fB-2ihtA:
undetectable		 4v1fA-2ihtA:
9.27
4v1fB-2ihtA:
9.27
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.
4YHA_B_MZMB303_1
(ALPHA-CARBONIC
ANHYDRASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 10 ASP A  24
ASN A 185
VAL A 149
LEU A  18
ALA A  14
 None
 1.36A 4yhaB-2ihtA:
undetectable		 4yhaB-2ihtA:
17.32
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.
4YVG_A_SAMA301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 SER A 470
GLY A 439
GLY A 465
ILE A 476
GLY A 441
 None
None
TPP  A 600 (-3.5A)
None
None
 0.96A 4yvgA-2ihtA:
undetectable		 4yvgA-2ihtA:
18.71
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.
5JKW_A_TESA601_1
(AROMATASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 ILE A 388
ILE A 406
VAL A 488
MET A 382
LEU A 539
 None
 1.46A 5jkwA-2ihtA:
undetectable		 5jkwA-2ihtA:
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.
5JL7_A_ASDA601_1
(AROMATASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 10 ILE A 388
ILE A 406
VAL A 488
MET A 382
LEU A 539
 None
 1.47A 5jl7A-2ihtA:
undetectable		 5jl7A-2ihtA:
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.
5JL9_A_ASDA601_1
(AROMATASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 9 ILE A 388
ILE A 406
VAL A 488
MET A 382
LEU A 539
 None
 1.49A 5jl9A-2ihtA:
0.0		 5jl9A-2ihtA:
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.
5MXB_A_ML1A222_1
(CLASS 10 PLANT
PATHOGENESIS-RELATED
PROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 10 THR A 249
TYR A 440
GLY A 428
ALA A 423
PHE A 429
 None
 1.02A 5mxbA-2ihtA:
undetectable		 5mxbA-2ihtA:
10.07
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.
5ODC_A_ACTA703_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 4 GLN A 425
GLN A 455
PRO A 401
ALA A 399
 None
 1.46A 5odcA-2ihtA:
1.4
5odcG-2ihtA:
2.2		 5odcA-2ihtA:
22.78
5odcG-2ihtA:
22.78
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.
5ODC_G_ACTG704_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 5 PRO A 401
ALA A 399
GLN A 425
GLN A 455
 None
 1.46A 5odcA-2ihtA:
3.1
5odcG-2ihtA:
1.8		 5odcA-2ihtA:
22.78
5odcG-2ihtA:
22.78
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.
5TE8_A_08JA602_1
(CYTOCHROME P450 3A4)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 7 ARG A  69
SER A 100
ALA A  64
ILE A 446
 None
 0.94A 5te8A-2ihtA:
undetectable		 5te8A-2ihtA:
21.64
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.
5TRQ_B_ACTB307_0
(WELO5)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 GLU A 497
HIS A 508
VAL A 512
 SO4  A 603 ( 4.6A)
None
None
 0.75A 5trqB-2ihtA:
undetectable		 5trqB-2ihtA:
19.48
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.
5UUN_A_ACTA303_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 GLU A 379
TYR A 378
ARG A 383
 None
 0.66A 5uunA-2ihtA:
undetectable		 5uunA-2ihtA:
20.80
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.
5UUN_B_ACTB305_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 GLU A 379
TYR A 378
ARG A 383
 None
 0.66A 5uunB-2ihtA:
undetectable		 5uunB-2ihtA:
20.80
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.
5WM2_A_ACTA605_0
(SALICYLATE-AMP
LIGASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 THR A  54
THR A 475
ARG A 478
 None
 1.04A 5wm2A-2ihtA:
3.1		 5wm2A-2ihtA:
24.33
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.
6AYB_A_KKKA508_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 PHE A 342
ALA A 206
ALA A 210
LEU A 243
LEU A 221
 None
 1.08A 6aybA-2ihtA:
undetectable		 6aybA-2ihtA:
23.00
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.
6BXM_A_SAMA402_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 LEU A 495
GLY A 494
LEU A 459
VAL A 486
ASP A 463
 TPP  A 600 ( 4.3A)
TPP  A 600 (-3.2A)
None
None
MG  A 601 ( 2.8A)
 1.20A 6bxmA-2ihtA:
3.1		 6bxmA-2ihtA:
19.62
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.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 PHE A 458
LEU A 540
LEU A 543
ARG A 544
 None
 0.93A 6e43A-2ihtA:
undetectable		 6e43A-2ihtA:
21.35
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.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 PHE A 458
LEU A 540
LEU A 543
ARG A 544
 None
 0.95A 6e43B-2ihtA:
undetectable		 6e43B-2ihtA:
21.35
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.
6E43_C_BEZC502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 PHE A 458
LEU A 540
LEU A 543
ARG A 544
 None
 0.96A 6e43C-2ihtA:
undetectable		 6e43C-2ihtA:
21.35
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.
6E43_D_BEZD502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 PHE A 458
LEU A 540
LEU A 543
ARG A 544
 None
 0.94A 6e43D-2ihtA:
undetectable		 6e43D-2ihtA:
21.35
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.
6F6N_A_SREA508_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		6 / 10 ILE A  41
VAL A 149
ALA A 152
LEU A  18
LEU A 168
LEU A  22
 None
 1.19A 6f6nA-2ihtA:
undetectable
6f6nB-2ihtA:
undetectable		 6f6nA-2ihtA:
8.96
6f6nB-2ihtA:
9.48
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.
6GTQ_A_ACTA204_0
(N-ACETYLTRANSFERASE)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 5 LEU A  81
THR A  80
THR A  86
GLY A  84
 None
 1.10A 6gtqA-2ihtA:
undetectable		 6gtqA-2ihtA:
14.38
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.
6MA6_A_MYTA603_0
(CYTOCHROME P450 3A4)		 2iht CARBOXYETHYLARGININE
SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 ARG A  69
SER A 100
ALA A  64
ALA A 448
 None
 1.14A 6ma6A-2ihtA:
undetectable		 6ma6A-2ihtA:
8.28