SIMILAR PATTERNS OF AMINO ACIDS FOR 1KI7_A_ID2A1_0

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.
1dbw TRANSCRIPTIONAL
REGULATORY PROTEIN
FIXJ

(Sinorhizobium
meliloti) 		PF00072
(Response_reg) 		5 ILE A 112
ILE A 111
MET A  22
ALA A  20
GLU A 116
 None
 1.32A 1ki7A-1dbwA:
1.4		 1ki7A-1dbwA:
16.67
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.
1eth TRIACYLGLYCEROL
ACYL-HYDROLASE

(Sus scrofa) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 HIS A 148
GLU A  98
ILE A 275
ILE A  90
TYR A 271
 None
 1.12A 1ki7A-1ethA:
0.0		 1ki7A-1ethA:
20.69
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.
1i2o TRANSALDOLASE B

(Escherichia
coli) 		PF00923
(TAL_FSA) 		5 ILE A 299
TYR A 103
GLN A 163
ALA A 291
ARG A 300
 None
 1.33A 1ki7A-1i2oA:
0.0		 1ki7A-1i2oA:
23.03
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.
1jqk CARBON MONOXIDE
DEHYDROGENASE

(Rhodospirillum
rubrum) 		PF03063
(Prismane) 		5 GLU A 283
ILE A 384
ILE A 260
ALA A 289
ARG A 385
 None
 1.35A 1ki7A-1jqkA:
2.4		 1ki7A-1jqkA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		5 ILE A  83
ILE A 108
TYR A  85
ARG A  60
GLU A 125
 None
 1.44A 1ki7A-1nt2A:
0.0		 1ki7A-1nt2A:
22.12
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.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN
CONSERVED
HYPOTHETICAL PROTEIN

(Archaeoglobus
fulgidus;
Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin)
PF01798
(Nop) 		5 ILE A  83
ILE A 108
TYR A  85
TYR B  61
ARG A  60
 None
 1.39A 1ki7A-1nt2A:
0.0		 1ki7A-1nt2A:
22.12
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.
1nu2 DISABLED HOMOLOG 1

(Mus musculus) 		PF00640
(PID) 		5 GLU A 169
ILE A 161
ALA A 174
ARG A 167
GLU A 163
 None
 1.31A 1ki7A-1nu2A:
undetectable		 1ki7A-1nu2A:
18.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1osn THYMIDINE KINASE

(Human
alphaherpesvirus
3) 		PF00693
(Herpes_TK) 		6 GLU A  48
TRP A  53
ILE A  62
ILE A  65
TYR A  66
GLN A  90
 BVP  A 500 (-2.5A)
BVP  A 500 (-4.6A)
BVP  A 500 (-4.5A)
BVP  A 500 ( 4.2A)
BVP  A 500 (-4.9A)
BVP  A 500 (-3.0A)
 0.64A 1ki7A-1osnA:
34.3		 1ki7A-1osnA:
31.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1p75 THYMIDINE KINASE

(Equid
alphaherpesvirus
4) 		PF00693
(Herpes_TK) 		6 GLU A  60
TRP A  65
ILE A  74
ILE A  77
TYR A  78
GLN A 102
 T5A  A 501 (-2.5A)
None
T5A  A 501 ( 4.4A)
T5A  A 501 ( 4.7A)
T5A  A 501 (-4.6A)
T5A  A 501 (-3.1A)
 0.68A 1ki7A-1p75A:
36.3		 1ki7A-1p75A:
38.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qor QUINONE
OXIDOREDUCTASE

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 HIS A 311
ILE A  43
ILE A  47
ALA A  94
TYR A  95
 None
SO4  A 328 (-3.6A)
None
None
None
 1.38A 1ki7A-1qorA:
undetectable		 1ki7A-1qorA:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u0k GENE PRODUCT PA4716

(Pseudomonas
aeruginosa) 		PF02567
(PhzC-PhzF) 		5 HIS A  75
ILE A  63
ILE A  48
ALA A  81
GLU A  46
 None
 1.19A 1ki7A-1u0kA:
undetectable		 1ki7A-1u0kA:
23.48
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.
1udd TRANSCRIPTIONAL
REGULATOR

(Pyrococcus
horikoshii) 		PF03070
(TENA_THI-4) 		5 GLU A 204
ILE A 143
TYR A  30
ALA A 211
TYR A  42
 None
 1.39A 1ki7A-1uddA:
undetectable		 1ki7A-1uddA:
20.30
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.
1vgj HYPOTHETICAL PROTEIN
PH0099

(Pyrococcus
horikoshii) 		PF02834
(LigT_PEase) 		5 HIS A  71
GLU A  98
ILE A  94
ILE A  41
ALA A 104
 None
 1.36A 1ki7A-1vgjA:
undetectable		 1ki7A-1vgjA:
19.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vtk THYMIDINE KINASE

(Human
alphaherpesvirus
1) 		PF00693
(Herpes_TK) 		11 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
ALA A 168
TYR A 172
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.5A)
TMP  A 500 (-3.7A)
TMP  A 500 (-3.5A)
 0.38A 1ki7A-1vtkA:
47.4		 1ki7A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vtk THYMIDINE KINASE

(Human
alphaherpesvirus
1) 		PF00693
(Herpes_TK) 		6 HIS A  58
ILE A  97
TYR A 101
ALA A 167
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 ( 4.5A)
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.2A)
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.94A 1ki7A-1vtkA:
47.4		 1ki7A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vtk THYMIDINE KINASE

(Human
alphaherpesvirus
1) 		PF00693
(Herpes_TK) 		11 HIS A  58
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
ALA A 168
TYR A 172
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.5A)
TMP  A 500 (-3.7A)
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.37A 1ki7A-1vtkA:
47.4		 1ki7A-1vtkA:
100.00
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.
1wz2 LEUCYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		5 GLU A 631
ILE A 622
ALA A 627
ARG A 484
GLU A 483
 None
 1.35A 1ki7A-1wz2A:
undetectable		 1ki7A-1wz2A:
15.73
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.
1yns E-1 ENZYME

(Homo sapiens) 		no annotation 5 GLU A  41
ILE A  35
MET A 117
ALA A 120
GLU A  37
 None
 1.47A 1ki7A-1ynsA:
undetectable		 1ki7A-1ynsA:
21.45
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.
2ani RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA SUBUNIT

(Chlamydia
trachomatis) 		PF00268
(Ribonuc_red_sm) 		5 HIS A 230
ILE A  96
ALA A  39
TYR A 112
GLU A 120
 FE  A 347 (-3.3A)
None
None
None
FE  A 347 ( 2.4A)
 1.10A 1ki7A-2aniA:
undetectable		 1ki7A-2aniA:
22.70
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.
2ani RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA SUBUNIT

(Chlamydia
trachomatis) 		PF00268
(Ribonuc_red_sm) 		5 HIS A 230
ILE A  96
ALA A 109
TYR A 112
GLU A 120
 FE  A 347 (-3.3A)
None
None
None
FE  A 347 ( 2.4A)
 1.07A 1ki7A-2aniA:
undetectable		 1ki7A-2aniA:
22.70
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.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox) 		PF00491
(Arginase) 		5 HIS A 151
GLU A 131
ILE A 138
ALA A 144
ARG A  64
 None
 1.25A 1ki7A-2cevA:
undetectable		 1ki7A-2cevA:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e6k TRANSKETOLASE

(Thermus
thermophilus) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLU A 603
ILE A 486
ALA A 489
ARG A 478
GLU A 579
 None
 1.35A 1ki7A-2e6kA:
undetectable		 1ki7A-2e6kA:
21.76
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.
2f2a GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A
ASPARTYL/GLUTAMYL-TR
NA(ASN/GLN)
AMIDOTRANSFERASE
SUBUNIT C

(Staphylococcus
aureus;
Staphylococcus
aureus) 		PF01425
(Amidase)
PF02686
(Glu-tRNAGln) 		5 GLU C   8
ILE C  35
ALA A 365
TYR A 374
GLU C  33
 None
 1.38A 1ki7A-2f2aC:
undetectable		 1ki7A-2f2aC:
16.62
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.
2j0a BETA-1,3-N-ACETYLGLU
COSAMINYLTRANSFERASE
MANIC FRINGE

(Mus musculus) 		PF02434
(Fringe) 		5 ILE A 239
ILE A 203
TYR A 166
MET A 211
ALA A 215
 None
 1.49A 1ki7A-2j0aA:
undetectable		 1ki7A-2j0aA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jcs DEOXYNUCLEOSIDE
KINASE

(Drosophila
melanogaster) 		PF01712
(dNK) 		5 TRP A  57
TYR A  70
GLN A  81
ALA A 110
GLU A 172
 None
TTP  A1210 (-4.6A)
TTP  A1210 (-3.0A)
TTP  A1210 (-3.4A)
TTP  A1210 (-3.6A)
 0.90A 1ki7A-2jcsA:
14.8		 1ki7A-2jcsA:
21.16
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.
2pv3 CHAPERONE SURA

(Escherichia
coli) 		PF00639
(Rotamase)
PF09312
(SurA_N) 		5 GLU A 416
ILE A  80
ALA A 421
ARG A 149
GLU A 145
 None
 1.38A 1ki7A-2pv3A:
undetectable		 1ki7A-2pv3A:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qn0 NEUROTOXIN

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		5 ILE A 241
TYR A 351
ALA A 268
TYR A 271
GLU A 290
 None
 1.40A 1ki7A-2qn0A:
undetectable		 1ki7A-2qn0A:
19.24
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.
2qzc TRANSCRIPTIONAL
ACTIVATOR TENA-1

(Sulfolobus
solfataricus) 		PF03070
(TENA_THI-4) 		5 GLU A  52
ILE A 102
ILE A  45
GLN A  46
ARG A  99
 None
 1.49A 1ki7A-2qzcA:
undetectable		 1ki7A-2qzcA:
19.18
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.
2r5f TRANSCRIPTIONAL
REGULATOR, PUTATIVE

(Pseudomonas
syringae group
genomosp. 3) 		PF04198
(Sugar-bind) 		5 GLU A 141
GLN A 162
ALA A 165
ARG A 202
GLU A 198
 None
 1.11A 1ki7A-2r5fA:
undetectable		 1ki7A-2r5fA:
23.68
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.
2y27 PHENYLACETATE-COENZY
ME A LIGASE

(Burkholderia
cenocepacia) 		PF00501
(AMP-binding)
PF14535
(AMP-binding_C_2) 		5 GLU A 250
ILE A 209
ALA A 123
ARG A 222
GLU A 226
 None
 0.97A 1ki7A-2y27A:
undetectable		 1ki7A-2y27A:
21.32
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.
2ys6 PHOSPHORIBOSYLGLYCIN
AMIDE SYNTHETASE

(Geobacillus
kaustophilus) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 HIS A 213
GLU A 191
ILE A 417
TYR A 231
ARG A 415
 None
 1.39A 1ki7A-2ys6A:
undetectable		 1ki7A-2ys6A:
22.54
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.
3deu TRANSCRIPTIONAL
REGULATOR SLYA

(Salmonella
enterica) 		PF01047
(MarR) 		5 GLU A  72
ILE A  91
ILE A  41
ALA A  97
ARG A  79
 None
 1.40A 1ki7A-3deuA:
undetectable		 1ki7A-3deuA:
18.24
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.
3f44 PUTATIVE
MONOOXYGENASE

(Lactobacillus
acidophilus) 		PF03992
(ABM) 		5 HIS A 180
ILE A 120
TYR A 186
ARG A 118
GLU A 169
 None
 1.45A 1ki7A-3f44A:
undetectable		 1ki7A-3f44A:
21.38
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.
3goa 3-KETOACYL-COA
THIOLASE

(Salmonella
enterica) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLU A 188
ILE A 357
ILE A   6
ALA A 247
GLU A 361
 None
 1.44A 1ki7A-3goaA:
undetectable		 1ki7A-3goaA:
24.88
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.
3h05 UNCHARACTERIZED
PROTEIN VPA0413

(Vibrio
parahaemolyticus) 		PF01467
(CTP_transf_like) 		5 GLU A  34
ILE A  92
ILE A  95
TYR A  96
ALA A  75
 None
 1.39A 1ki7A-3h05A:
undetectable		 1ki7A-3h05A:
17.82
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.
3kez PUTATIVE SUGAR
BINDING PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 GLU A 416
ILE A 276
GLN A 343
ALA A 351
ARG A 357
 None
None
CA  A 501 (-3.6A)
None
None
 1.42A 1ki7A-3kezA:
undetectable		 1ki7A-3kezA:
20.99
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.
3kum DIPEPTIDE EPIMERASE

(Enterococcus
faecalis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A  33
ILE A 299
TYR A  45
ALA A 328
GLU A  35
 None
 1.47A 1ki7A-3kumA:
undetectable		 1ki7A-3kumA:
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.
3lop SUBSTRATE BINDING
PERIPLASMIC PROTEIN

(Ralstonia
solanacearum) 		PF13458
(Peripla_BP_6) 		5 GLU A 328
ILE A  72
ILE A  77
ALA A 323
TYR A  62
 None
 1.37A 1ki7A-3lopA:
undetectable		 1ki7A-3lopA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o04 BETA-KETO-ACYL
CARRIER PROTEIN
SYNTHASE II

(Listeria
monocytogenes) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLU A 113
ILE A 195
ILE A 231
ARG A  73
GLU A 233
 None
 1.45A 1ki7A-3o04A:
undetectable		 1ki7A-3o04A:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pfm GGDEF DOMAIN PROTEIN

(Pseudomonas
protegens) 		PF00563
(EAL) 		5 GLU A 630
ILE A 590
ILE A 587
ALA A 436
ARG A 597
 None
 1.29A 1ki7A-3pfmA:
undetectable		 1ki7A-3pfmA:
22.35
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.
3pju CYCLIC DIMERIC GMP
BINDING PROTEIN

(Pseudomonas
fluorescens) 		PF00563
(EAL) 		5 GLU A 630
ILE A 590
ILE A 587
ALA A 436
ARG A 597
 None
 1.46A 1ki7A-3pjuA:
undetectable		 1ki7A-3pjuA:
24.25
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.
3pjx CYCLIC DIMERIC GMP
BINDING PROTEIN

(Pseudomonas
fluorescens) 		PF00563
(EAL)
PF00990
(GGDEF) 		5 GLU A 230
ILE A 600
TYR A 586
ALA A 606
ARG A 233
 None
 1.44A 1ki7A-3pjxA:
undetectable		 1ki7A-3pjxA:
25.49
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.
3qak ADENOSINE RECEPTOR
A2A,LYSOZYME CHIMERA

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 HIS A 278
ILE A  64
TYR A   9
ALA A  81
GLU A  13
 UKA  A1200 (-3.9A)
None
None
None
None
 1.41A 1ki7A-3qakA:
undetectable		 1ki7A-3qakA:
20.78
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.
3qpt TRANSCRIPTIONAL
REGULATOR SLYA

(Salmonella
enterica) 		PF01047
(MarR) 		5 GLU A  71
ILE A  90
ILE A  40
ALA A  96
ARG A  78
 None
 1.47A 1ki7A-3qptA:
undetectable		 1ki7A-3qptA:
18.13
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.
3tqh QUINONE
OXIDOREDUCTASE

(Coxiella
burnetii) 		PF08240
(ADH_N)
PF13602
(ADH_zinc_N_2) 		5 HIS A  38
ILE A  77
ILE A  35
ALA A 106
GLU A  75
 None
 1.32A 1ki7A-3tqhA:
undetectable		 1ki7A-3tqhA:
23.88
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.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		5 ILE A 148
ILE A 187
TYR A 190
GLN A 141
ALA A 140
 None
 1.38A 1ki7A-3zizA:
undetectable		 1ki7A-3zizA:
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.
4mpt PUTATIVE
LEU/ILE/VAL-BINDING
PROTEIN

(Bordetella
pertussis) 		PF13458
(Peripla_BP_6) 		5 GLU A 313
ILE A  40
ILE A  45
ALA A 308
ARG A 316
 None
 1.28A 1ki7A-4mptA:
undetectable		 1ki7A-4mptA:
22.03
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.
4noh LIPOPROTEIN,
PUTATIVE

(Bacillus
anthracis) 		PF17294
(Lipoprotein_22) 		5 ILE A 164
TYR A  36
MET A  74
ALA A 147
TYR A 146
 None
 1.23A 1ki7A-4nohA:
undetectable		 1ki7A-4nohA:
16.47
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.
4oca UDP-4-AMINO-4-DEOXY-
L-ARABINOSE--OXOGLUT
ARATE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF01041
(DegT_DnrJ_EryC1) 		5 HIS A 135
ILE A 132
ILE A 158
MET A  67
ALA A  63
 None
None
None
None
2QR  A 400 (-3.3A)
 1.41A 1ki7A-4ocaA:
undetectable		 1ki7A-4ocaA:
23.63
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.
4pzv 2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE/DI
HYDROPTEROATE
SYNTHASE

(Francisella
tularensis) 		PF00809
(Pterin_bind)
PF01288
(HPPK) 		5 GLU A 206
ILE A 416
ILE A 413
ARG A 172
GLU A 409
 None
 1.34A 1ki7A-4pzvA:
undetectable		 1ki7A-4pzvA:
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.
4qnn PHOSPHOLIPASE A 1
FROM HORNET(VESPA
BASALIS) VENOM

(Vespa basalis) 		PF00151
(Lipase) 		5 ILE A 134
ILE A  49
MET A  65
ALA A  68
ARG A 132
 None
 1.45A 1ki7A-4qnnA:
undetectable		 1ki7A-4qnnA:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		5 ILE A 201
ILE A 254
TYR A 251
ALA A 214
GLU A 196
 None
None
None
None
CA  A 503 (-2.2A)
 1.17A 1ki7A-4tx8A:
undetectable		 1ki7A-4tx8A:
22.56
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.
4uop LIPOTEICHOIC ACID
PRIMASE

(Listeria
monocytogenes) 		PF00884
(Sulfatase) 		5 ILE A 233
ILE A 512
TYR A 453
MET A 310
TYR A 287
 None
 1.49A 1ki7A-4uopA:
2.0		 1ki7A-4uopA:
18.98
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.
5fb3 GLYCEROL-1-PHOSPHATE
DEHYDROGENASE
[NAD(P)+]

(Pyrobaculum
calidifontis) 		PF13685
(Fe-ADH_2) 		5 GLU A  66
ILE A  60
ILE A  36
TYR A  90
GLU A  58
 SO4  A2004 (-3.8A)
SO4  A2004 (-3.9A)
None
None
SO4  A2004 ( 4.2A)
 1.07A 1ki7A-5fb3A:
undetectable		 1ki7A-5fb3A:
23.40
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.
5h3x FIBRONECTIN/FIBRINOG
EN BINDING PROTEIN

(Streptococcus
suis) 		PF05833
(FbpA) 		5 HIS A 126
GLU A 121
GLN A  33
ALA A  52
ARG A 154
 None
 1.19A 1ki7A-5h3xA:
undetectable		 1ki7A-5h3xA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5huc 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE (DAHP)
SYNTHASE

(Corynebacterium
glutamicum) 		PF01474
(DAHP_synth_2) 		5 HIS A 257
ILE A 161
TYR A 264
ALA A  98
GLU A 265
 None
 1.32A 1ki7A-5hucA:
undetectable		 1ki7A-5hucA:
22.92
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.
5iqj UNCHARACTERIZED
PROTEIN

(Vibrio cholerae) 		no annotation 5 HIS A 121
ILE A  73
ILE A  69
TYR A  72
ALA A 128
 None
 1.17A 1ki7A-5iqjA:
undetectable		 1ki7A-5iqjA:
18.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jfc NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT BETA

(Pyrococcus
furiosus) 		PF10418
(DHODB_Fe-S_bind) 		5 GLU S  14
ILE S  67
ALA S 117
ARG S  12
GLU S  24
 None
 1.42A 1ki7A-5jfcS:
undetectable		 1ki7A-5jfcS:
20.29
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.
5kd5 METALLOPEPTIDASE

(Bacteroides
thetaiotaomicron) 		PF13402
(Peptidase_M60)
PF17291
(M60-like_N) 		5 GLU A 813
ILE A 838
ALA A 619
TYR A 623
ARG A 815
 None
 1.13A 1ki7A-5kd5A:
undetectable		 1ki7A-5kd5A:
20.04
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.
5lnk MITOCHONDRIAL
COMPLEX I, ND5
SUBUNIT
MITOCHONDRIAL
COMPLEX I, AGGG
SUBUNIT

(Ovis aries;
Ovis aries) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N)
PF06455
(NADH5_C)
no annotation 		5 TRP u  33
ILE L 374
ILE L 375
MET u  32
ALA u  30
 None
 1.41A 1ki7A-5lnku:
undetectable		 1ki7A-5lnku:
12.21
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.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 ILE A 551
ILE A 550
TYR A 567
GLN A 512
ALA A 543
 None
 1.08A 1ki7A-5n6uA:
undetectable		 1ki7A-5n6uA:
16.13
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.
5vt9 MYOSIN LIGHT CHAIN
TGMLC1
MYOSIN-A

(Toxoplasma
gondii;
Toxoplasma
gondii) 		no annotation
no annotation 		5 ILE C 806
ILE A 173
TYR A 177
ALA A 155
TYR A 156
 None
 1.46A 1ki7A-5vt9C:
undetectable		 1ki7A-5vt9C:
10.53
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.
5y3x BETA-XYLANASE

(Caldicellulosiruptor
owensensis) 		no annotation 5 GLU A 114
ILE A 169
ILE A 165
ARG A 117
GLU A 172
 None
 1.18A 1ki7A-5y3xA:
undetectable		 1ki7A-5y3xA:
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.
6aqf ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 5 HIS A 278
ILE A  64
TYR A   9
ALA A  81
GLU A  13
 None
OLA  A1206 ( 4.0A)
None
None
None
 1.46A 1ki7A-6aqfA:
undetectable		 1ki7A-6aqfA:
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.
6c8z ADP-DEPENDENT
PHOSPHOFRUCTOKINASE

(Methanosarcinales) 		no annotation 5 HIS A  40
TRP A 182
ILE A 184
ILE A 183
ALA A 111
 None
 1.17A 1ki7A-6c8zA:
undetectable		 1ki7A-6c8zA:
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.
6fri ALKANAL
MONOOXYGENASE BETA
CHAIN

(Photobacterium
leiognathi) 		no annotation 5 ILE A  88
GLN A  78
MET A  58
ALA A  56
GLU A  90
 None
 1.45A 1ki7A-6friA:
undetectable		 1ki7A-6friA:
undetectable