SIMILAR PATTERNS OF AMINO ACIDS FOR 1C4D_B_DVAB8

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1fft UBIQUINOL OXIDASE

(Escherichia
coli) 		PF00115
(COX1) 		3 TRP A 460
VAL A 428
TRP A 383
 None
 1.16A 1c4dA-1fftA:
undetectable
1c4dB-1fftA:
undetectable		 1c4dA-1fftA:
2.52
1c4dB-1fftA:
2.52
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.
1jyl CTP:PHOSPHOCHOLINE
CYTIDYLYLTRANSFERASE

(Streptococcus
pneumoniae) 		PF00483
(NTP_transferase) 		3 TRP A 165
VAL A 174
TRP A 191
 None
 1.29A 1c4dA-1jylA:
undetectable
1c4dB-1jylA:
undetectable		 1c4dA-1jylA:
5.73
1c4dB-1jylA:
5.73
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		3 TRP A 479
VAL A  69
TRP A 541
 PQQ  A1800 (-4.8A)
None
GOL  A1823 (-4.9A)
 1.18A 1c4dA-1kb0A:
undetectable
1c4dB-1kb0A:
undetectable		 1c4dA-1kb0A:
2.73
1c4dB-1kb0A:
2.73
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.
1mg1 PROTEIN (HTLV-1 GP21
ECTODOMAIN/MALTOSE-B
INDING PROTEIN
CHIMERA)

(Primate
T-lymphotropic
virus 1) 		PF00429
(TLV_coat)
PF13416
(SBP_bac_8) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MAL  A 456 (-3.9A)
 1.13A 1c4dA-1mg1A:
undetectable
1c4dB-1mg1A:
undetectable		 1c4dA-1mg1A:
2.78
1c4dB-1mg1A:
2.78
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.
1nd7 WW DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00632
(HECT) 		3 TRP A 812
VAL A 817
TRP A 832
 None
 1.22A 1c4dA-1nd7A:
undetectable
1c4dB-1nd7A:
undetectable		 1c4dA-1nd7A:
4.49
1c4dB-1nd7A:
4.49
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.
1olx 2-OXOISOVALERATE
DEHYDROGENASE BETA
SUBUNIT

(Homo sapiens) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 TRP B 227
VAL B 163
TRP B 136
 None
 1.15A 1c4dA-1olxB:
undetectable
1c4dB-1olxB:
undetectable		 1c4dA-1olxB:
3.93
1c4dB-1olxB:
3.93
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.
1suv TRANSFERRIN RECEPTOR
PROTEIN 1

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		3 TRP A 466
VAL A 461
TRP A 453
 None
 1.25A 1c4dA-1suvA:
undetectable
1c4dB-1suvA:
undetectable		 1c4dA-1suvA:
3.70
1c4dB-1suvA:
3.70
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.
1u10 PENICILLIN-INSENSITI
VE MUREIN
ENDOPEPTIDASE

(Escherichia
coli) 		PF03411
(Peptidase_M74) 		3 TRP A 203
VAL A 178
TRP A 242
 None
 1.06A 1c4dA-1u10A:
undetectable
1c4dB-1u10A:
undetectable		 1c4dA-1u10A:
8.18
1c4dB-1u10A:
8.18
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.
1uok OLIGO-1,6-GLUCOSIDAS
E

(Bacillus cereus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 320
VAL A  10
TRP A   6
 None
 1.21A 1c4dA-1uokA:
undetectable
1c4dB-1uokA:
undetectable		 1c4dA-1uokA:
4.20
1c4dB-1uokA:
4.20
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.
1urh 3-MERCAPTOPYRUVATE
SULFURTRANSFERASE

(Escherichia
coli) 		PF00581
(Rhodanese) 		3 TRP A   4
VAL A   6
TRP A 104
 None
 1.23A 1c4dA-1urhA:
undetectable
1c4dB-1urhA:
undetectable		 1c4dA-1urhA:
4.92
1c4dB-1urhA:
4.92
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.
1vft ALANINE RACEMASE

(Streptomyces
lavendulae) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 TRP A  84
VAL A 102
TRP A 166
 DCS  A 401 ( 3.9A)
None
KCX  A 129 ( 3.4A)
 0.83A 1c4dA-1vftA:
undetectable
1c4dB-1vftA:
undetectable		 1c4dA-1vftA:
11.20
1c4dB-1vftA:
11.20
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.
1vmg HYPOTHETICAL PROTEIN
SSO3215

(Sulfolobus
solfataricus) 		PF03819
(MazG) 		3 TRP A  31
VAL A  33
TRP A  61
 None
None
UNL  A  85 (-3.6A)
 1.06A 1c4dA-1vmgA:
undetectable
1c4dB-1vmgA:
undetectable		 1c4dA-1vmgA:
14.58
1c4dB-1vmgA:
14.58
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.
1w6v UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 15

(Homo sapiens) 		PF06337
(DUSP) 		3 TRP A  41
VAL A  60
TRP A  37
 None
 1.23A 1c4dA-1w6vA:
undetectable
1c4dB-1w6vA:
undetectable		 1c4dA-1w6vA:
6.31
1c4dB-1w6vA:
6.31
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.
1y4c MALTOSE BINDING
PROTEIN FUSED WITH
DESIGNED HELICAL
PROTEIN

(Escherichia
coli) 		PF13416
(SBP_bac_8) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
GLC  A 372 (-3.6A)
 1.28A 1c4dA-1y4cA:
undetectable
1c4dB-1y4cA:
undetectable		 1c4dA-1y4cA:
3.17
1c4dB-1y4cA:
3.17
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.
1yw6 SUCCINYLGLUTAMATE
DESUCCINYLASE

(Escherichia
coli) 		PF04952
(AstE_AspA) 		3 TRP A 142
VAL A  47
TRP A  79
 None
 1.07A 1c4dA-1yw6A:
undetectable
1c4dB-1yw6A:
undetectable		 1c4dA-1yw6A:
3.59
1c4dB-1yw6A:
3.59
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.
2h31 MULTIFUNCTIONAL
PROTEIN ADE2

(Homo sapiens) 		PF00731
(AIRC)
PF01259
(SAICAR_synt) 		3 TRP A 180
VAL A 188
TRP A 214
 None
 1.09A 1c4dA-2h31A:
undetectable
1c4dB-2h31A:
undetectable		 1c4dA-2h31A:
3.04
1c4dB-2h31A:
3.04
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.
2hu9 MERCURIC TRANSPORT
PROTEIN PERIPLASMIC
COMPONENT

(Archaeoglobus
fulgidus) 		no annotation 3 TRP A 121
VAL A 110
TRP A  12
 ACY  A 301 (-4.9A)
None
None
 1.00A 1c4dA-2hu9A:
undetectable
1c4dB-2hu9A:
undetectable		 1c4dA-2hu9A:
9.82
1c4dB-2hu9A:
9.82
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.
2lrn THIOL:DISULFIDE
INTERCHANGE PROTEIN

(Bacteroides sp.
4_3_47FAA) 		PF00578
(AhpC-TSA) 		3 TRP A  88
VAL A  34
TRP A  37
 None
 1.27A 1c4dA-2lrnA:
undetectable
1c4dB-2lrnA:
undetectable		 1c4dA-2lrnA:
11.54
1c4dB-2lrnA:
11.54
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.
2ouw ALKYLHYDROPEROXIDASE
AHPD CORE

(Rhodospirillum
rubrum) 		PF02627
(CMD) 		3 TRP A  52
VAL A  18
TRP A  38
 None
 1.27A 1c4dA-2ouwA:
undetectable
1c4dB-2ouwA:
undetectable		 1c4dA-2ouwA:
6.67
1c4dB-2ouwA:
6.67
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.
2pwh SUCROSE ISOMERASE

([Pseudomonas]
mesoacidophila) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		3 TRP A 318
VAL A  11
TRP A   7
 None
 1.28A 1c4dA-2pwhA:
undetectable
1c4dB-2pwhA:
undetectable		 1c4dA-2pwhA:
1.82
1c4dB-2pwhA:
1.82
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.
2w2s MATRIX PROTEIN

(Lagos bat
lyssavirus) 		PF04785
(Rhabdo_M2) 		3 TRP A 169
VAL A  93
TRP A 181
 None
 1.24A 1c4dA-2w2sA:
undetectable
1c4dB-2w2sA:
undetectable		 1c4dA-2w2sA:
6.15
1c4dB-2w2sA:
6.15
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.
2w2s MATRIX PROTEIN

(Lagos bat
lyssavirus) 		PF04785
(Rhabdo_M2) 		3 TRP A 181
VAL A  93
TRP A 169
 None
 1.14A 1c4dA-2w2sA:
undetectable
1c4dB-2w2sA:
undetectable		 1c4dA-2w2sA:
6.15
1c4dB-2w2sA:
6.15
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.
2ymu WD-40 REPEAT PROTEIN

(Nostoc
punctiforme) 		PF00400
(WD40) 		3 TRP A 143
VAL A 186
TRP A 184
 None
 1.12A 1c4dA-2ymuA:
undetectable
1c4dB-2ymuA:
undetectable		 1c4dA-2ymuA:
2.45
1c4dB-2ymuA:
2.45
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.
2ymu WD-40 REPEAT PROTEIN

(Nostoc
punctiforme) 		PF00400
(WD40) 		3 TRP A 553
VAL A 309
TRP A 307
 None
 1.07A 1c4dA-2ymuA:
undetectable
1c4dB-2ymuA:
undetectable		 1c4dA-2ymuA:
2.45
1c4dB-2ymuA:
2.45
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.
2ze0 ALPHA-GLUCOSIDASE

(Geobacillus sp.
HTA-462) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 317
VAL A  10
TRP A   6
 None
 1.25A 1c4dA-2ze0A:
undetectable
1c4dB-2ze0A:
undetectable		 1c4dA-2ze0A:
3.99
1c4dB-2ze0A:
3.99
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.
3a3c MALTOSE-BINDING
PERIPLASMIC PROTEIN,
LINKER,
MITOCHONDRIAL
INTERMEMBRANE SPACE
IMPORT AND ASSEMBLY
PROTEIN 40

(Escherichia
coli;
Saccharomyces
cerevisiae;
synthetic
construct) 		PF06747
(CHCH)
PF13416
(SBP_bac_8) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MAL  A 466 (-2.6A)
 1.26A 1c4dA-3a3cA:
undetectable
1c4dB-3a3cA:
undetectable		 1c4dA-3a3cA:
5.21
1c4dB-3a3cA:
5.21
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		3 TRP A 226
VAL A  25
TRP A  28
 GOL  A5001 (-3.5A)
None
None
 0.91A 1c4dA-3abzA:
undetectable
1c4dB-3abzA:
undetectable		 1c4dA-3abzA:
4.50
1c4dB-3abzA:
4.50
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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N) 		3 TRP A1134
VAL A1241
TRP A1232
 None
 1.30A 1c4dA-3egwA:
undetectable
1c4dB-3egwA:
undetectable		 1c4dA-3egwA:
1.73
1c4dB-3egwA:
1.73
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.
3ehs FUSION PROTEIN OF
CRFR1 EXTRACELLULAR
DOMAIN AND MBP

(Escherichia
coli;
Homo sapiens) 		PF02793
(HRM)
PF13416
(SBP_bac_8) 		3 TRP A-191
VAL A -90
TRP A  -9
 None
None
MAL  A 126 (-3.7A)
 1.28A 1c4dA-3ehsA:
undetectable
1c4dB-3ehsA:
undetectable		 1c4dA-3ehsA:
3.13
1c4dB-3ehsA:
3.13
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.
3gdh TRIMETHYLGUANOSINE
SYNTHASE HOMOLOG

(Homo sapiens) 		PF09445
(Methyltransf_15) 		3 TRP A 648
VAL A 641
TRP A 669
 None
 1.29A 1c4dA-3gdhA:
undetectable
1c4dB-3gdhA:
undetectable		 1c4dA-3gdhA:
8.16
1c4dB-3gdhA:
8.16
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.
3git CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		PF03598
(CdhC) 		3 TRP A 427
VAL A 430
TRP A 418
 None
None
GOL  A 743 (-2.9A)
 1.18A 1c4dA-3gitA:
undetectable
1c4dB-3gitA:
undetectable		 1c4dA-3gitA:
3.93
1c4dB-3gitA:
3.93
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.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		PF03598
(CdhC) 		3 TRP M 427
VAL M 430
TRP M 418
 None
 1.14A 1c4dA-3i04M:
undetectable
1c4dB-3i04M:
undetectable		 1c4dA-3i04M:
2.56
1c4dB-3i04M:
2.56
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.
3l2k EHPF

(Pantoea
agglomerans) 		PF00501
(AMP-binding) 		3 TRP A 112
VAL A 107
TRP A 321
 None
 1.27A 1c4dA-3l2kA:
undetectable
1c4dB-3l2kA:
undetectable		 1c4dA-3l2kA:
3.68
1c4dB-3l2kA:
3.68
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.
3l2p DNA LIGASE 3

(Homo sapiens) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		3 TRP A 729
VAL A 607
TRP A 636
 None
 1.26A 1c4dA-3l2pA:
undetectable
1c4dB-3l2pA:
undetectable		 1c4dA-3l2pA:
2.32
1c4dB-3l2pA:
2.32
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.
3lmn UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 15

(Homo sapiens) 		PF06337
(DUSP) 		3 TRP A  41
VAL A  60
TRP A  37
 None
 1.23A 1c4dA-3lmnA:
undetectable
1c4dB-3lmnA:
undetectable		 1c4dA-3lmnA:
11.67
1c4dB-3lmnA:
11.67
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.
3nbh RECQ-MEDIATED GENOME
INSTABILITY PROTEIN
2

(Homo sapiens) 		PF16100
(RMI2) 		3 TRP B  59
VAL B 102
TRP B 135
 None
 0.89A 1c4dA-3nbhB:
undetectable
1c4dB-3nbhB:
undetectable		 1c4dA-3nbhB:
6.02
1c4dB-3nbhB:
6.02
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.
3ne5 CATION EFFLUX SYSTEM
PROTEIN CUSA

(Escherichia
coli) 		PF00873
(ACR_tran) 		3 TRP A 916
VAL A 550
TRP A 552
 None
 1.11A 1c4dA-3ne5A:
undetectable
1c4dB-3ne5A:
undetectable		 1c4dA-3ne5A:
2.70
1c4dB-3ne5A:
2.70
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.
3ob4 MALTOSE ABC
TRANSPORTER
PERIPLASMIC PROTEIN,
ARAH 2

(Escherichia
coli;
Arachis
duranensis) 		PF00234
(Tryp_alpha_amyl)
PF13416
(SBP_bac_8) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MLR  A 400 (-3.8A)
 1.23A 1c4dA-3ob4A:
undetectable
1c4dB-3ob4A:
undetectable		 1c4dA-3ob4A:
5.21
1c4dB-3ob4A:
5.21
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.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		3 TRP A 804
VAL A 880
TRP A 789
 None
 1.20A 1c4dA-3ob8A:
undetectable
1c4dB-3ob8A:
undetectable		 1c4dA-3ob8A:
1.58
1c4dB-3ob8A:
1.58
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.
3t79 KLLA0E03807P

(Kluyveromyces
lactis) 		PF16787
(NDC10_II) 		3 TRP A 268
VAL A 271
TRP A 275
 None
 0.97A 1c4dA-3t79A:
undetectable
1c4dB-3t79A:
undetectable		 1c4dA-3t79A:
2.24
1c4dB-3t79A:
2.24
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.
3ua4 PROTEIN ARGININE
N-METHYLTRANSFERASE
5

(Caenorhabditis
elegans) 		PF05185
(PRMT5)
PF17285
(PRMT5_TIM)
PF17286
(PRMT5_C) 		3 TRP A 130
VAL A  89
TRP A  94
 None
 1.09A 1c4dA-3ua4A:
undetectable
1c4dB-3ua4A:
undetectable		 1c4dA-3ua4A:
5.08
1c4dB-3ua4A:
5.08
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.
3uyj LYSINE-SPECIFIC
DEMETHYLASE 8

(Homo sapiens) 		PF13621
(Cupin_8) 		3 TRP A 310
VAL A 330
TRP A 414
 AKG  A 601 (-3.1A)
None
AKG  A 601 (-4.4A)
 1.28A 1c4dA-3uyjA:
undetectable
1c4dB-3uyjA:
undetectable		 1c4dA-3uyjA:
7.48
1c4dB-3uyjA:
7.48
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.
3wy2 ALPHA-GLUCOSIDASE

(Halomonas sp.
H11) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		3 TRP A 324
VAL A  12
TRP A   8
 None
 1.24A 1c4dA-3wy2A:
undetectable
1c4dB-3wy2A:
undetectable		 1c4dA-3wy2A:
4.09
1c4dB-3wy2A:
4.09
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.
4a3p UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 15

(Homo sapiens) 		PF06337
(DUSP)
PF14836
(Ubiquitin_3) 		3 TRP A  41
VAL A  60
TRP A  37
 None
 1.26A 1c4dA-4a3pA:
undetectable
1c4dB-4a3pA:
undetectable		 1c4dA-4a3pA:
6.32
1c4dB-4a3pA:
6.32
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.
4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Lactobacillus
acidophilus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 307
VAL A   9
TRP A   5
 None
 1.06A 1c4dA-4aieA:
undetectable
1c4dB-4aieA:
undetectable		 1c4dA-4aieA:
2.68
1c4dB-4aieA:
2.68
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.
4b3n MALTOSE-BINDING
PERIPLASMIC PROTEIN,
TRIPARTITE
MOTIF-CONTAINING
PROTEIN 5

(Escherichia
coli;
Macaca mulatta) 		PF00622
(SPRY)
PF01547
(SBP_bac_1) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MAL  A 500 (-3.9A)
 1.30A 1c4dA-4b3nA:
undetectable
1c4dB-4b3nA:
undetectable		 1c4dA-4b3nA:
5.21
1c4dB-4b3nA:
5.21
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.
4b8j IMPORTIN SUBUNIT
ALPHA-1A

(Oryza sativa) 		PF00514
(Arm)
PF01749
(IBB)
PF16186
(Arm_3) 		3 TRP A 138
VAL A 174
TRP A 180
 None
 1.15A 1c4dA-4b8jA:
undetectable
1c4dB-4b8jA:
undetectable		 1c4dA-4b8jA:
3.39
1c4dB-4b8jA:
3.39
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.
4c0h MRNA CLEAVAGE AND
POLYADENYLATION
FACTOR CLP1

(Saccharomyces
cerevisiae) 		PF06807
(Clp1)
PF16573
(CLP1_N)
PF16575
(CLP1_P) 		3 TRP A  85
VAL A  27
TRP A  34
 None
 0.99A 1c4dA-4c0hA:
undetectable
1c4dB-4c0hA:
undetectable		 1c4dA-4c0hA:
4.94
1c4dB-4c0hA:
4.94
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.
4cad RAS AND A-FACTOR
CONVERTING ENZYME 1,
RCE1

(Methanococcus
maripaludis) 		PF02517
(Abi) 		3 TRP C 172
VAL C  18
TRP C  24
 None
 1.09A 1c4dA-4cadC:
undetectable
1c4dB-4cadC:
undetectable		 1c4dA-4cadC:
7.69
1c4dB-4cadC:
7.69
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.
4gfi MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A  97
VAL A  92
TRP A 326
 None
 1.28A 1c4dA-4gfiA:
undetectable
1c4dB-4gfiA:
undetectable		 1c4dA-4gfiA:
17.86
1c4dB-4gfiA:
17.86
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.
4ifp MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NACHT, LRR
AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Escherichia
coli;
Homo sapiens) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MAL  A 501 (-3.7A)
 1.28A 1c4dA-4ifpA:
undetectable
1c4dB-4ifpA:
undetectable		 1c4dA-4ifpA:
2.78
1c4dB-4ifpA:
2.78
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.
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio rerio) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MTT  A 501 (-4.0A)
 1.30A 1c4dA-4irlA:
undetectable
1c4dB-4irlA:
undetectable		 1c4dA-4irlA:
5.21
1c4dB-4irlA:
5.21
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.
4jb7 ACCESSORY
COLONIZATION FACTOR
ACFC

(Vibrio cholerae) 		PF13531
(SBP_bac_11) 		3 TRP A 197
VAL A 195
TRP A 191
 None
 1.08A 1c4dA-4jb7A:
undetectable
1c4dB-4jb7A:
undetectable		 1c4dA-4jb7A:
5.71
1c4dB-4jb7A:
5.71
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.
4kv3 CHIMERA FUSION
PROTEIN OF ESX-1
SECRETION SYSTEM
PROTEIN ECCD1 AND
MALTOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli;
Mycobacterium
tuberculosis) 		PF08817
(YukD)
PF13416
(SBP_bac_8) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MAL  A 501 (-3.7A)
 1.30A 1c4dA-4kv3A:
undetectable
1c4dB-4kv3A:
undetectable		 1c4dA-4kv3A:
2.05
1c4dB-4kv3A:
2.05
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.
4m64 MELIBIOSE CARRIER
PROTEIN

(Salmonella
enterica) 		PF13347
(MFS_2) 		3 TRP A 342
VAL A 371
TRP A 128
 None
 1.08A 1c4dA-4m64A:
undetectable
1c4dB-4m64A:
undetectable		 1c4dA-4m64A:
4.00
1c4dB-4m64A:
4.00
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.
4m8u OLIGO-1,6-GLUCOSIDAS
E 1

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 323
VAL A   9
TRP A   5
 None
 1.23A 1c4dA-4m8uA:
undetectable
1c4dB-4m8uA:
undetectable		 1c4dA-4m8uA:
3.25
1c4dB-4m8uA:
3.25
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.
4m8u OLIGO-1,6-GLUCOSIDAS
E 1

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 323
VAL A  10
TRP A   5
 None
 1.10A 1c4dA-4m8uA:
undetectable
1c4dB-4m8uA:
undetectable		 1c4dA-4m8uA:
3.25
1c4dB-4m8uA:
3.25
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.
4my2 MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NORRIN FUSION
PROTEIN

(Escherichia
coli;
Homo sapiens) 		PF00007
(Cys_knot)
PF13416
(SBP_bac_8) 		3 TRP A 160
VAL A 261
TRP A 342
 None
None
MAL  A1201 (-3.6A)
 1.30A 1c4dA-4my2A:
undetectable
1c4dB-4my2A:
undetectable		 1c4dA-4my2A:
5.21
1c4dB-4my2A:
5.21
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.
4nxi UNCHARACTERIZED
PROTEIN

(Mycobacterium
tuberculosis) 		PF01323
(DSBA) 		3 TRP A 181
VAL A  35
TRP A  28
 None
 1.22A 1c4dA-4nxiA:
undetectable
1c4dB-4nxiA:
undetectable		 1c4dA-4nxiA:
6.47
1c4dB-4nxiA:
6.47
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.
4ofl EXTRACYTOPLASMIC
NICKEL-BINDING
PROTEIN YPYNTA

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		3 TRP A 385
VAL A 287
TRP A 456
 HIS  A 502 (-3.9A)
None
None
 1.16A 1c4dA-4oflA:
undetectable
1c4dB-4oflA:
undetectable		 1c4dA-4oflA:
2.88
1c4dB-4oflA:
2.88
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.
4pe2 MALTOSE ABC
TRANSPORTER
PERIPLASMIC
PROTEIN,PREPILIN-TYP
E N-TERMINAL
CLEAVAGE/METHYLATION
DOMAIN PROTEIN

(Escherichia
coli;
Clostridioides
difficile) 		PF13416
(SBP_bac_8) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MAL  A 601 (-3.8A)
 1.28A 1c4dA-4pe2A:
undetectable
1c4dB-4pe2A:
undetectable		 1c4dA-4pe2A:
5.21
1c4dB-4pe2A:
5.21
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.
4pe6 PUTATIVE ABC
TRANSPORTER

(Thermobispora
bispora) 		PF13407
(Peripla_BP_4) 		3 TRP A 328
VAL A 286
TRP A 340
 None
 1.12A 1c4dA-4pe6A:
undetectable
1c4dB-4pe6A:
undetectable		 1c4dA-4pe6A:
8.28
1c4dB-4pe6A:
8.28
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.
4pqk MALTOSE ABC
TRANSPORTER
PERIPLASMIC PROTEIN,
TRUNCATED
REPLICATION PROTEIN
REPA

(Escherichia
coli;
Staphylococcus
aureus) 		PF13416
(SBP_bac_8) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MLR  A 700 (-4.0A)
 1.25A 1c4dA-4pqkA:
undetectable
1c4dB-4pqkA:
undetectable		 1c4dA-4pqkA:
5.21
1c4dB-4pqkA:
5.21
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.
4psp ALPHA-FUCOSIDASE
GH29

(Fusarium
graminearum) 		PF01120
(Alpha_L_fucos)
PF16757
(Fucosidase_C) 		3 TRP A 155
VAL A 123
TRP A  35
 None
 1.08A 1c4dA-4pspA:
undetectable
1c4dB-4pspA:
undetectable		 1c4dA-4pspA:
2.60
1c4dB-4pspA:
2.60
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.
4psu ALPHA/BETA HYDROLASE

(Rhodopseudomonas
palustris) 		PF12697
(Abhydrolase_6) 		3 TRP A  14
VAL A  32
TRP A   7
 None
 0.98A 1c4dA-4psuA:
undetectable
1c4dB-4psuA:
undetectable		 1c4dA-4psuA:
4.86
1c4dB-4psuA:
4.86
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.
4qbj GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Aspergillus
fumigatus) 		PF01233
(NMT)
PF02799
(NMT_C) 		3 TRP A 166
VAL A 343
TRP A 341
 None
 0.89A 1c4dA-4qbjA:
undetectable
1c4dB-4qbjA:
undetectable		 1c4dA-4qbjA:
7.30
1c4dB-4qbjA:
7.30
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.
4qsz MALTOSE-BINDING
PERIPLASMIC PROTEIN,
JMJC
DOMAIN-CONTAINING
PROTEIN 7 CHIMERA

(Escherichia
coli;
Mus musculus) 		PF13416
(SBP_bac_8)
PF13621
(Cupin_8) 		3 TRP A-213
VAL A-112
TRP A -31
 None
None
GLC  A 902 ( 3.6A)
 1.24A 1c4dA-4qszA:
undetectable
1c4dB-4qszA:
undetectable		 1c4dA-4qszA:
2.08
1c4dB-4qszA:
2.08
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.
4rw3 PHOSPHOLIPASE D
LISICTOX-ALPHAIA1BII

(Loxosceles
intermedia) 		no annotation 3 TRP A   8
VAL A  89
TRP A 189
 None
 1.24A 1c4dA-4rw3A:
undetectable
1c4dB-4rw3A:
undetectable		 1c4dA-4rw3A:
3.52
1c4dB-4rw3A:
3.52
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.
4u36 SEED LECTIN

(Vatairea
macrocarpa) 		PF00139
(Lectin_legB) 		3 TRP A 155
VAL A 160
TRP A 153
 None
 1.30A 1c4dA-4u36A:
undetectable
1c4dB-4u36A:
undetectable		 1c4dA-4u36A:
5.47
1c4dB-4u36A:
5.47
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.
4wmo XEEL PROTEIN

(Xenopus laevis) 		no annotation 3 TRP F 190
VAL F 337
TRP F 179
 None
 1.24A 1c4dA-4wmoF:
undetectable
1c4dB-4wmoF:
undetectable		 1c4dA-4wmoF:
6.40
1c4dB-4wmoF:
6.40
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.
4wmy INTELECTIN-1

(Homo sapiens) 		no annotation 3 TRP A 161
VAL A 308
TRP A 150
 None
 1.12A 1c4dA-4wmyA:
undetectable
1c4dB-4wmyA:
undetectable		 1c4dA-4wmyA:
4.59
1c4dB-4wmyA:
4.59
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.
4xai MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG

(Escherichia
coli;
Tribolium
castaneum) 		PF00104
(Hormone_recep)
PF13416
(SBP_bac_8) 		3 TRP A 160
VAL A 261
TRP A 342
 None
None
MAL  A1401 (-3.7A)
 1.29A 1c4dA-4xaiA:
undetectable
1c4dB-4xaiA:
undetectable		 1c4dA-4xaiA:
3.05
1c4dB-4xaiA:
3.05
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.
4xaj MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NUCLEAR
RECEPTOR SUBFAMILY 2
GROUP E MEMBER 1

(Escherichia
coli;
Homo sapiens) 		PF00104
(Hormone_recep)
PF13416
(SBP_bac_8) 		3 TRP A 160
VAL A 261
TRP A 342
 None
None
MAL  A1900 ( 4.0A)
 1.27A 1c4dA-4xajA:
undetectable
1c4dB-4xajA:
undetectable		 1c4dA-4xajA:
2.12
1c4dB-4xajA:
2.12
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.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 304
VAL A  11
TRP A   6
 None
 1.07A 1c4dA-4xb3A:
undetectable
1c4dB-4xb3A:
undetectable		 1c4dA-4xb3A:
3.72
1c4dB-4xb3A:
3.72
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.
4y6t COAT PROTEIN

(Tobacco streak
virus) 		PF01787
(Ilar_coat) 		3 TRP A 200
VAL A 144
TRP A 107
 None
 0.85A 1c4dA-4y6tA:
undetectable
1c4dB-4y6tA:
undetectable		 1c4dA-4y6tA:
12.68
1c4dB-4y6tA:
12.68
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.
4z4l CELLOBIOSE
2-EPIMERASE

(Caldicellulosiruptor
saccharolyticus) 		PF07221
(GlcNAc_2-epim) 		3 TRP A 355
VAL A 357
TRP A 307
 None
 1.21A 1c4dA-4z4lA:
undetectable
1c4dB-4z4lA:
undetectable		 1c4dA-4z4lA:
3.93
1c4dB-4z4lA:
3.93
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.
5a3i ANTI-HAEMAGGLUTININ
HA1 FAB HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TRP C  33
VAL C 112
TRP C 109
 None
 1.16A 1c4dA-5a3iC:
undetectable
1c4dB-5a3iC:
undetectable		 1c4dA-5a3iC:
5.23
1c4dB-5a3iC:
5.23
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.
5brq GLYCOSIDE HYDROLASE
FAMILY 13

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 320
VAL A  13
TRP A   9
 None
 1.21A 1c4dA-5brqA:
undetectable
1c4dB-5brqA:
undetectable		 1c4dA-5brqA:
7.43
1c4dB-5brqA:
7.43
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.
5c7r FUSION PROTEIN OF
MALTOSE-BINDING
PERIPLASMIC PROTEIN
AND TYPE-3
ICE-STRUCTURING
PROTEIN HPLC 12

(Escherichia
coli;
Zoarces
americanus) 		PF01547
(SBP_bac_1) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MLR  A 501 (-4.0A)
 1.26A 1c4dA-5c7rA:
undetectable
1c4dB-5c7rA:
undetectable		 1c4dA-5c7rA:
2.38
1c4dB-5c7rA:
2.38
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.
5cfv MALTOSE-BINDING
PERIPLASMIC
PROTEIN,MALTOSE-BIND
ING PERIPLASMIC
PROTEIN,PILA FUSION
PROTEIN

(Escherichia
coli;
Acinetobacter
nosocomialis) 		PF00114
(Pilin)
PF01547
(SBP_bac_1) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MAL  A1201 (-3.7A)
 1.25A 1c4dA-5cfvA:
undetectable
1c4dB-5cfvA:
undetectable		 1c4dA-5cfvA:
5.21
1c4dB-5cfvA:
5.21
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.
5do8 LMO0184 PROTEIN

(Listeria
monocytogenes) 		no annotation 3 TRP B 319
VAL B  11
TRP B   7
 None
 1.24A 1c4dA-5do8B:
undetectable
1c4dB-5do8B:
undetectable		 1c4dA-5do8B:
2.67
1c4dB-5do8B:
2.67
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.
5do8 LMO0184 PROTEIN

(Listeria
monocytogenes) 		no annotation 3 TRP B 319
VAL B  12
TRP B   7
 None
 1.10A 1c4dA-5do8B:
undetectable
1c4dB-5do8B:
undetectable		 1c4dA-5do8B:
2.67
1c4dB-5do8B:
2.67
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.
5fac ALANINE RACEMASE

(Streptomyces
coelicolor) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 TRP A  96
VAL A 114
TRP A 179
 PLP  A 401 (-3.4A)
None
KCX  A 141 (-3.6A)
 0.82A 1c4dA-5facA:
undetectable
1c4dB-5facA:
undetectable		 1c4dA-5facA:
7.04
1c4dB-5facA:
7.04
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.
5g5a GLUTATHIONE
S-TRANSFERASE U25

(Arabidopsis
thaliana) 		PF02798
(GST_N)
PF13410
(GST_C_2) 		3 TRP A 114
VAL A 106
TRP A 163
 None
 1.01A 1c4dA-5g5aA:
undetectable
1c4dB-5g5aA:
undetectable		 1c4dA-5g5aA:
9.88
1c4dB-5g5aA:
9.88
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.
5ggy IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-COMPOUND-BINDIN
G PROTEIN

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		3 TRP A  86
VAL A  88
TRP A 293
 None
None
CL  A 401 (-4.1A)
 1.25A 1c4dA-5ggyA:
undetectable
1c4dB-5ggyA:
undetectable		 1c4dA-5ggyA:
6.44
1c4dB-5ggyA:
6.44
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.
5gpq MALTOSE-BINDING
PERIPLASMIC
PROTEIN,APOPTOSIS-AS
SOCIATED SPECK-LIKE
PROTEIN CONTAINING A
CARD

(Escherichia
coli;
Danio rerio) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MAL  A 501 (-3.7A)
 1.29A 1c4dA-5gpqA:
undetectable
1c4dB-5gpqA:
undetectable		 1c4dA-5gpqA:
5.21
1c4dB-5gpqA:
5.21
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.
5gqr LEUCINE-RICH REPEAT
RECEPTOR-LIKE
PROTEIN KINASE TDR

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		3 TRP B  68
VAL B  75
TRP B  71
 None
 1.04A 1c4dA-5gqrB:
undetectable
1c4dB-5gqrB:
undetectable		 1c4dA-5gqrB:
3.21
1c4dB-5gqrB:
3.21
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.
5gw7 GLUCOSIDASE YGJK

(Escherichia
coli) 		PF01204
(Trehalase) 		3 TRP A 350
VAL A 366
TRP A 385
 None
 1.08A 1c4dA-5gw7A:
undetectable
1c4dB-5gw7A:
undetectable		 1c4dA-5gw7A:
1.76
1c4dB-5gw7A:
1.76
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.
5hz7 COMP

(Neisseria
meningitidis) 		PF13416
(SBP_bac_8)
PF16732
(ComP_DUS) 		3 TRP A 159
VAL A 260
TRP A 341
 None
None
MLR  A 501 (-3.1A)
 1.30A 1c4dA-5hz7A:
undetectable
1c4dB-5hz7A:
undetectable		 1c4dA-5hz7A:
2.78
1c4dB-5hz7A:
2.78
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.
5ijx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Coccidioides
posadasii) 		PF00579
(tRNA-synt_1b) 		3 TRP A 310
VAL A 278
TRP A 271
 None
 1.00A 1c4dA-5ijxA:
undetectable
1c4dB-5ijxA:
undetectable		 1c4dA-5ijxA:
9.73
1c4dB-5ijxA:
9.73
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.
5jj4 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,SINGLE-STRAN
DED DNA CYTOSINE
DEAMINASE

(Escherichia
coli;
Homo sapiens) 		no annotation 3 TRP C 158
VAL C 259
TRP C 340
 None
None
MTT  C1203 (-4.0A)
 1.24A 1c4dA-5jj4C:
undetectable
1c4dB-5jj4C:
undetectable		 1c4dA-5jj4C:
2.29
1c4dB-5jj4C:
2.29
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.
5lly DIGUANYLATE CYCLASE
(GGDEF)
DOMAIN-CONTAINING
PROTEIN

(Idiomarina sp.
A28L) 		no annotation 3 TRP D 397
VAL D 384
TRP D 386
 None
 1.00A 1c4dA-5llyD:
undetectable
1c4dB-5llyD:
undetectable		 1c4dA-5llyD:
3.95
1c4dB-5llyD:
3.95
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.
5nij VACUOLAR-PROCESSING
ENZYME GAMMA-ISOZYME

(Arabidopsis
thaliana) 		no annotation 3 TRP A  71
VAL A 383
TRP A 485
 CIT  A 502 ( 4.9A)
None
CIT  A 502 (-4.0A)
 1.16A 1c4dA-5nijA:
undetectable
1c4dB-5nijA:
undetectable		 1c4dA-5nijA:
undetectable
1c4dB-5nijA:
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.
5o32 COMPLEMENT FACTOR I

(Homo sapiens) 		PF00089
(Trypsin) 		3 TRP I 399
VAL I 397
TRP I 393
 None
 1.14A 1c4dA-5o32I:
undetectable
1c4dB-5o32I:
undetectable		 1c4dA-5o32I:
6.44
1c4dB-5o32I:
6.44
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.
5t38 EVDMO1

(Micromonospora
carbonacea) 		PF13847
(Methyltransf_31) 		3 TRP A 159
VAL A 173
TRP A 194
 None
 1.27A 1c4dA-5t38A:
undetectable
1c4dB-5t38A:
undetectable		 1c4dA-5t38A:
5.50
1c4dB-5t38A:
5.50
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.
5tj2 SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN,GASDERMIN-B
FUSION PROTEIN

(Escherichia
coli;
Homo sapiens) 		PF04598
(Gasdermin)
PF13416
(SBP_bac_8) 		3 TRP A 158
VAL A 259
TRP A 340
 None
None
MAL  A1501 (-3.8A)
 1.29A 1c4dA-5tj2A:
undetectable
1c4dB-5tj2A:
undetectable		 1c4dA-5tj2A:
1.89
1c4dB-5tj2A:
1.89
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.
5ttd MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PILIN
ISOPEPTIDE LINKAGE
DOMAIN PROTEIN

(Escherichia
coli;
Streptococcus
pyogenes) 		PF12892
(FctA)
PF13416
(SBP_bac_8) 		3 TRP A 164
VAL A 265
TRP A 346
 None
None
MLR  A 501 (-3.9A)
 1.30A 1c4dA-5ttdA:
undetectable
1c4dB-5ttdA:
undetectable		 1c4dA-5ttdA:
2.55
1c4dB-5ttdA:
2.55
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.
5v6y MALTOSE-BINDING
PERIPLASMIC
PROTEIN,RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 1,CALCITONIN
GENE-RELATED PEPTIDE
TYPE 1 RECEPTOR

(Escherichia
coli;
Homo sapiens) 		no annotation 3 TRP A 160
VAL A 261
TRP A 342
 None
None
MAL  A2201 (-3.7A)
 1.28A 1c4dA-5v6yA:
undetectable
1c4dB-5v6yA:
undetectable		 1c4dA-5v6yA:
undetectable
1c4dB-5v6yA:
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 TRP C2164
VAL C2187
TRP C2245
 None
 1.24A 1c4dA-5y3rC:
undetectable
1c4dB-5y3rC:
undetectable		 1c4dA-5y3rC:
0.42
1c4dB-5y3rC:
0.42
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.
5z0r EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY
1,VIRAL GENOME
PROTEIN

(Escherichia
coli) 		no annotation 3 TRP A 159
VAL A 260
TRP A 341
 None
None
MAL  A 501 (-2.7A)
 1.22A 1c4dA-5z0rA:
undetectable
1c4dB-5z0rA:
undetectable		 1c4dA-5z0rA:
undetectable
1c4dB-5z0rA:
undetectable