SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ic9'

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.
1HK2_A_T44A3002_1
(SERUM ALBUMIN)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 GLN A 210
ASN A 208
LEU A 209
LEU A 317
None
None
None
FAD  A 490 (-4.2A)
0.99A 1hk2A-3ic9A:
3.7
1hk2A-3ic9A:
22.77
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.
1LWC_A_NVPA999_1
(HIV-1 REVERSE
TRANSCRIPTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 11 PRO A 171
LEU A 190
VAL A 176
GLY A 183
LEU A  54
None
1.17A 1lwcA-3ic9A:
undetectable
1lwcA-3ic9A:
21.03
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.
1RJD_A_SAMA801_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLN A 388
ALA A 422
GLY A 399
SER A 391
LEU A 400
None
1.04A 1rjdA-3ic9A:
undetectable
1rjdA-3ic9A:
22.38
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.
1RJD_B_SAMB802_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLN A 388
ALA A 422
GLY A 399
SER A 391
LEU A 400
None
1.01A 1rjdB-3ic9A:
undetectable
1rjdB-3ic9A:
22.38
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.
1RJD_C_SAMC803_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLN A 388
ALA A 422
GLY A 399
SER A 391
LEU A 400
None
1.00A 1rjdC-3ic9A:
undetectable
1rjdC-3ic9A:
22.38
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.
1U72_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 ALA A 154
LEU A 151
ASN A 161
LEU A 164
VAL A 174
None
None
FAD  A 490 (-3.7A)
None
None
1.30A 1u72A-3ic9A:
undetectable
1u72A-3ic9A:
18.68
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.
2A1H_B_GBNB501_1
(BRANCHED CHAIN
AMINOTRANSFERASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 THR A 141
GLY A  14
THR A  15
ALA A  16
FAD  A 490 (-4.0A)
FAD  A 490 (-3.2A)
FAD  A 490 (-4.4A)
FAD  A 490 (-3.6A)
0.85A 2a1hA-3ic9A:
undetectable
2a1hB-3ic9A:
undetectable
2a1hA-3ic9A:
23.00
2a1hB-3ic9A:
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.
2BR4_F_SAMF301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 LEU A 276
GLU A  35
GLY A  12
ALA A 140
ALA A 308
None
FAD  A 490 (-2.8A)
FAD  A 490 (-3.1A)
None
None
1.00A 2br4F-3ic9A:
undetectable
2br4F-3ic9A:
17.76
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.
2BXG_B_IBPB2002_1
(SERUM ALBUMIN)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
6 / 10 ALA A  60
ALA A  57
LEU A  54
LEU A 193
ALA A 189
SER A  65
None
1.34A 2bxgB-3ic9A:
3.4
2bxgB-3ic9A:
22.94
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.
2HDN_L_TACL6888_1
(ELONGATION FACTOR
EF-TU)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 6 VAL A 273
THR A 316
SER A 143
ASP A 310
None
None
None
FAD  A 490 (-3.0A)
1.30A 2hdnJ-3ic9A:
undetectable
2hdnK-3ic9A:
undetectable
2hdnL-3ic9A:
undetectable
2hdnJ-3ic9A:
21.60
2hdnK-3ic9A:
6.18
2hdnL-3ic9A:
21.60
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.
2NMY_A_ROCA401_1
(PROTEASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
6 / 12 ARG A 344
ASP A 324
GLY A 309
ALA A 308
ILE A  10
GLY A  14
None
NA  A 491 (-3.0A)
FAD  A 490 ( 3.3A)
None
None
FAD  A 490 (-3.2A)
1.34A 2nmyA-3ic9A:
undetectable
2nmyA-3ic9A:
11.18
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.
2NYU_A_SAMA201_0
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLY A  14
GLY A 142
ALA A 311
VAL A  99
MET A  18
FAD  A 490 (-3.2A)
FAD  A 490 (-3.3A)
None
None
None
0.87A 2nyuA-3ic9A:
undetectable
2nyuA-3ic9A:
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.
2VN1_A_FK5A501_2
(70 KDA
PEPTIDYLPROLYL
ISOMERASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 6 LEU A 428
SER A 391
PHE A 385
GLU A 453
None
1.30A 2vn1B-3ic9A:
undetectable
2vn1B-3ic9A:
12.88
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.
2Y7H_C_SAMC530_1
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
3 / 3 TYR A  62
GLU A 353
ASN A 397
None
1.02A 2y7hC-3ic9A:
2.5
2y7hC-3ic9A:
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.
3AOD_C_RFPC2002_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 ALA A 463
THR A 438
PHE A 447
GLY A 414
LEU A 401
None
1.46A 3aodC-3ic9A:
undetectable
3aodC-3ic9A:
19.92
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.
3NDX_A_RITA100_2
(PROTEASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
6 / 11 ARG A 344
ASP A 324
GLY A 309
ALA A 308
ILE A  10
GLY A  14
None
NA  A 491 (-3.0A)
FAD  A 490 ( 3.3A)
None
None
FAD  A 490 (-3.2A)
1.32A 3ndxB-3ic9A:
undetectable
3ndxB-3ic9A:
10.98
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.
3QFX_B_CP6B702_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 ALA A   9
ILE A  34
PHE A 118
THR A 141
ILE A 139
None
FAD  A 490 ( 4.8A)
None
FAD  A 490 (-4.0A)
None
1.16A 3qfxB-3ic9A:
undetectable
3qfxB-3ic9A:
20.22
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.
4DAJ_B_0HKB2000_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
3 / 3 ASN A 312
LEU A 276
PHE A 306
NA  A 491 (-2.6A)
None
None
0.78A 4dajB-3ic9A:
undetectable
4dajB-3ic9A:
21.36
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.
4F3T_A_IPHA902_0
(PROTEIN ARGONAUTE-2)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 6 LEU A  54
LYS A  52
LEU A 186
GLU A 185
None
FAD  A 490 (-3.1A)
None
None
1.06A 4f3tA-3ic9A:
undetectable
4f3tA-3ic9A:
21.09
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.
4FEU_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 ASP A 324
ASN A 312
GLU A 295
ASP A 310
NA  A 491 (-3.0A)
NA  A 491 (-2.6A)
None
FAD  A 490 (-3.0A)
0.96A 4feuD-3ic9A:
undetectable
4feuD-3ic9A:
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.
4FEV_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ASP A 324
ASN A 312
GLU A 295
ASP A 310
NA  A 491 (-3.0A)
NA  A 491 (-2.6A)
None
FAD  A 490 (-3.0A)
1.00A 4fevB-3ic9A:
undetectable
4fevB-3ic9A:
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.
4GKH_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 ASP A 324
ASN A 312
GLU A 295
ASP A 310
NA  A 491 (-3.0A)
NA  A 491 (-2.6A)
None
FAD  A 490 (-3.0A)
1.02A 4gkhD-3ic9A:
undetectable
4gkhD-3ic9A:
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.
4GKI_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 9 ASP A 324
ARG A 269
ASN A 312
GLU A 295
ASP A 310
NA  A 491 (-3.0A)
FAD  A 490 ( 3.9A)
NA  A 491 (-2.6A)
None
FAD  A 490 (-3.0A)
1.10A 4gkiF-3ic9A:
0.0
4gkiF-3ic9A:
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.
4IJI_H_BEZH501_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN YIBF)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ALA A  60
SER A  61
VAL A  84
ARG A  87
None
0.77A 4ijiH-3ic9A:
undetectable
4ijiH-3ic9A:
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.
4KIC_A_SAMA401_0
(METHYLTRANSFERASE
MPPJ)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLY A  36
ARG A  45
ILE A  11
ALA A 116
ALA A 140
FAD  A 490 (-4.0A)
None
FAD  A 490 (-4.8A)
FAD  A 490 (-4.1A)
None
1.15A 4kicA-3ic9A:
2.7
4kicA-3ic9A:
23.80
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.
4RV6_A_RPBA1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 11 GLN A 373
GLY A 410
TYR A 404
ALA A 463
LYS A 466
None
1.14A 4rv6A-3ic9A:
undetectable
4rv6A-3ic9A:
22.31
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.
4RV6_B_RPBB1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 11 GLN A 373
GLY A 410
TYR A 404
ALA A 463
LYS A 466
None
1.14A 4rv6B-3ic9A:
undetectable
4rv6B-3ic9A:
22.31
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.
4XV2_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 4 GLY A  37
LEU A 276
PHE A 118
ILE A  11
FAD  A 490 ( 4.2A)
None
None
FAD  A 490 (-4.8A)
0.81A 4xv2A-3ic9A:
undetectable
4xv2A-3ic9A:
19.25
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.
4YVP_B_GBMB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 LEU A 170
VAL A  84
ILE A  88
LEU A 159
LEU A 164
None
1.32A 4yvpB-3ic9A:
undetectable
4yvpB-3ic9A:
22.06
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.
5A06_A_SORA1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
None
FAD  A 490 (-2.8A)
FAD  A 490 (-3.2A)
None
0.81A 5a06A-3ic9A:
undetectable
5a06A-3ic9A:
22.59
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.
5A06_B_SORB1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
None
FAD  A 490 (-2.8A)
FAD  A 490 (-3.2A)
None
0.83A 5a06B-3ic9A:
undetectable
5a06B-3ic9A:
22.59
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.
5A06_C_SORC1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
None
FAD  A 490 (-2.8A)
FAD  A 490 (-3.2A)
None
0.79A 5a06C-3ic9A:
undetectable
5a06C-3ic9A:
22.59
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.
5A06_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
None
FAD  A 490 (-2.8A)
FAD  A 490 (-3.2A)
None
0.81A 5a06E-3ic9A:
undetectable
5a06E-3ic9A:
22.59
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.
5A06_F_SORF1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
None
FAD  A 490 (-2.8A)
FAD  A 490 (-3.2A)
None
0.81A 5a06F-3ic9A:
undetectable
5a06F-3ic9A:
22.59
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.
5D0Y_A_FOLA201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 LEU A 184
GLY A 178
SER A 143
ASN A 208
VAL A 350
None
1.15A 5d0yA-3ic9A:
undetectable
5d0yA-3ic9A:
18.76
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.
5DSG_A_0HKA1201_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
3 / 3 ASN A 312
LEU A 276
PHE A 306
NA  A 491 (-2.6A)
None
None
0.71A 5dsgA-3ic9A:
undetectable
5dsgA-3ic9A:
21.26
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.
5DSG_A_0HKA1201_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
3 / 3 ASN A 312
LEU A 278
PHE A 306
NA  A 491 (-2.6A)
None
None
0.78A 5dsgA-3ic9A:
undetectable
5dsgA-3ic9A:
21.26
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.
5EKX_A_SAMA301_0
(NS5
METHYLTRANSFERASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLY A 325
GLY A  12
GLY A  14
GLY A  19
ILE A  11
None
FAD  A 490 (-3.1A)
FAD  A 490 (-3.2A)
None
FAD  A 490 (-4.8A)
1.02A 5ekxA-3ic9A:
undetectable
5ekxA-3ic9A:
undetectable
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.
5HBM_A_NVPA601_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 11 PRO A 171
LEU A 190
VAL A 176
GLY A 183
LEU A  54
None
1.08A 5hbmA-3ic9A:
undetectable
5hbmA-3ic9A:
21.26
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.
5V0V_A_8QPA613_1
(SERUM ALBUMIN)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 ALA A 308
VAL A 138
THR A  13
GLY A 329
None
1.00A 5v0vA-3ic9A:
3.8
5v0vA-3ic9A:
21.27
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.
5Y9M_A_NIOA401_1
(CASEIN KINASE II
SUBUNIT ALPHA')
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 LEU A 190
VAL A 195
VAL A 174
ASP A 169
None
0.64A 5y9mA-3ic9A:
undetectable
5y9mA-3ic9A:
10.04
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.
5Y9M_X_NIOX401_1
(CASEIN KINASE II
SUBUNIT ALPHA')
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 8 LEU A 190
VAL A 195
VAL A 174
ASP A 169
None
0.65A 5y9mX-3ic9A:
undetectable
5y9mX-3ic9A:
10.04
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.
6BRD_A_RFPA502_2
(RIFAMPIN
MONOOXYGENASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
4 / 4 GLN A 188
VAL A 176
ARG A  87
ARG A 192
None
1.44A 6brdA-3ic9A:
11.1
6brdA-3ic9A:
11.46
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.
6EXI_A_ADNA503_0
(ADENOSYLHOMOCYSTEINA
SE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 10 GLY A  12
GLY A  14
GLU A  35
THR A 141
ASN A 272
FAD  A 490 (-3.1A)
FAD  A 490 (-3.2A)
FAD  A 490 (-2.8A)
FAD  A 490 (-4.0A)
FAD  A 490 ( 4.9A)
0.77A 6exiA-3ic9A:
undetectable
6exiA-3ic9A:
15.12
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.
6EXI_B_ADNB503_1
(ADENOSYLHOMOCYSTEINA
SE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 10 GLY A  12
GLY A  14
GLU A  35
THR A 141
ASN A 272
FAD  A 490 (-3.1A)
FAD  A 490 (-3.2A)
FAD  A 490 (-2.8A)
FAD  A 490 (-4.0A)
FAD  A 490 ( 4.9A)
0.80A 6exiB-3ic9A:
undetectable
6exiB-3ic9A:
15.12
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.
6EXI_C_ADNC503_0
(ADENOSYLHOMOCYSTEINA
SE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLY A  12
GLY A  14
GLU A  35
THR A 141
ASN A 272
FAD  A 490 (-3.1A)
FAD  A 490 (-3.2A)
FAD  A 490 (-2.8A)
FAD  A 490 (-4.0A)
FAD  A 490 ( 4.9A)
0.80A 6exiC-3ic9A:
2.3
6exiD-3ic9A:
2.2
6exiC-3ic9A:
15.12
6exiD-3ic9A:
15.12
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.
6EXI_D_ADND503_0
(ADENOSYLHOMOCYSTEINA
SE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 GLY A  12
GLY A  14
GLU A  35
THR A 141
ASN A 272
FAD  A 490 (-3.1A)
FAD  A 490 (-3.2A)
FAD  A 490 (-2.8A)
FAD  A 490 (-4.0A)
FAD  A 490 ( 4.9A)
0.78A 6exiC-3ic9A:
2.3
6exiD-3ic9A:
2.2
6exiC-3ic9A:
15.12
6exiD-3ic9A:
15.12
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.
6R2E_C_FFOC404_0
(THYMIDYLATE SYNTHASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 10 PHE A 351
ILE A  55
LEU A 170
LEU A 186
GLY A 187
FAD  A 490 (-4.8A)
None
None
None
None
1.42A 6r2eC-3ic9A:
undetectable
6r2eC-3ic9A:
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.
6R2E_H_FFOH403_0
(THYMIDYLATE SYNTHASE)
3ic9 DIHYDROLIPOAMIDE
DEHYDROGENASE

(Colwellia
psychrerythraea)
5 / 12 PHE A 351
ILE A  55
LEU A 170
LEU A 186
GLY A 187
FAD  A 490 (-4.8A)
None
None
None
None
1.26A 6r2eH-3ic9A:
undetectable
6r2eH-3ic9A:
22.36