SIMILAR PATTERNS OF AMINO ACIDS FOR 1QAB_E_RTLE1_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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iiu PLASMA
RETINOL-BINDING
PROTEIN

(Gallus gallus) 		PF00061
(Lipocalin) 		5 PHE A  36
ALA A  43
MET A  88
HIS A 104
TYR A 133
 None
RTL  A 176 ( 4.1A)
RTL  A 176 (-3.4A)
RTL  A 176 ( 4.7A)
None
 1.14A 1qabE-1iiuA:
26.5		 1qabE-1iiuA:
84.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iiu PLASMA
RETINOL-BINDING
PROTEIN

(Gallus gallus) 		PF00061
(Lipocalin) 		11 PHE A  36
LEU A  37
ALA A  57
VAL A  61
MET A  73
MET A  88
TYR A  90
LEU A  97
GLN A  98
HIS A 104
TYR A 133
 None
RTL  A 176 ( 4.5A)
RTL  A 176 ( 3.8A)
None
RTL  A 176 ( 4.0A)
RTL  A 176 (-3.4A)
RTL  A 176 ( 4.0A)
RTL  A 176 (-4.0A)
RTL  A 176 (-3.8A)
RTL  A 176 ( 4.7A)
None
 0.82A 1qabE-1iiuA:
26.5		 1qabE-1iiuA:
84.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iiu PLASMA
RETINOL-BINDING
PROTEIN

(Gallus gallus) 		PF00061
(Lipocalin) 		8 PHE A  36
LEU A  37
VAL A  61
MET A  73
LEU A  97
GLN A  98
HIS A 117
TYR A 133
 None
RTL  A 176 ( 4.5A)
None
RTL  A 176 ( 4.0A)
RTL  A 176 (-4.0A)
RTL  A 176 (-3.8A)
RTL  A 176 ( 4.6A)
None
 1.30A 1qabE-1iiuA:
26.5		 1qabE-1iiuA:
84.00
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.
1pp1 P40 NUCLEOPROTEIN

(Borna disease
virus) 		PF06407
(BDV_P40) 		5 PHE X 282
LEU X 211
VAL X 207
MET X 223
LEU X 144
 None
 1.48A 1qabE-1pp1X:
0.0		 1qabE-1pp1X:
18.21
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.
1wxx HYPOTHETICAL PROTEIN
TTHA1280

(Thermus
thermophilus) 		PF10672
(Methyltrans_SAM) 		5 LEU A 130
ALA A 121
LEU A  76
GLN A 132
HIS A 124
 None
 1.30A 1qabE-1wxxA:
0.0		 1qabE-1wxxA:
18.02
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.
2c0k HEMOGLOBIN

(Gasterophilus
intestinalis) 		PF00042
(Globin) 		5 LEU A  67
ALA A  23
VAL A  70
MET A  27
LEU A 110
 None
None
None
None
HEM  A1152 ( 4.6A)
 1.47A 1qabE-2c0kA:
undetectable		 1qabE-2c0kA:
20.32
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.
2cu1 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 2

(Homo sapiens) 		PF00564
(PB1) 		5 LEU A  33
VAL A  28
TYR A  49
LEU A  71
HIS A  48
 None
 1.39A 1qabE-2cu1A:
0.0		 1qabE-2cu1A:
17.74
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.
2iya OLEANDOMYCIN
GLYCOSYLTRANSFERASE

(Streptomyces
antibioticus) 		PF00201
(UDPGT) 		5 PHE A  18
LEU A 101
ALA A 104
VAL A  97
HIS A  14
 None
 1.30A 1qabE-2iyaA:
0.0		 1qabE-2iyaA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pim PHENYLACETIC ACID
DEGRADATION-RELATED
PROTEIN

(Cupriavidus
pinatubonensis) 		PF13622
(4HBT_3) 		5 PHE A  91
ALA A  62
VAL A  55
MET A  63
LEU A 100
 None
 1.42A 1qabE-2pimA:
0.0		 1qabE-2pimA:
17.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wq9 RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		5 ALA A  43
VAL A  61
MET A  88
HIS A 104
TYR A 133
 OLA  A1179 ( 4.0A)
None
OLA  A1179 ( 3.8A)
OLA  A1179 (-4.5A)
OLA  A1179 ( 3.7A)
 1.41A 1qabE-2wq9A:
26.1		 1qabE-2wq9A:
98.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wq9 RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		9 LEU A  37
ALA A  57
MET A  73
MET A  88
TYR A  90
LEU A  97
GLN A  98
HIS A 104
TYR A 133
 OLA  A1179 (-3.4A)
OLA  A1179 ( 3.7A)
OLA  A1179 ( 4.9A)
OLA  A1179 ( 3.8A)
OLA  A1179 (-3.7A)
None
None
OLA  A1179 (-4.5A)
OLA  A1179 ( 3.7A)
 0.85A 1qabE-2wq9A:
26.1		 1qabE-2wq9A:
98.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wq9 RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		9 LEU A  37
VAL A  61
MET A  73
MET A  88
TYR A  90
LEU A  97
GLN A  98
HIS A 104
TYR A 133
 OLA  A1179 (-3.4A)
None
OLA  A1179 ( 4.9A)
OLA  A1179 ( 3.8A)
OLA  A1179 (-3.7A)
None
None
OLA  A1179 (-4.5A)
OLA  A1179 ( 3.7A)
 0.97A 1qabE-2wq9A:
26.1		 1qabE-2wq9A:
98.25
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.
2yax SULFUR
OXYGENASE/REDUCTASE

(Acidianus
ambivalens) 		PF07682
(SOR) 		5 PHE B  54
LEU B  52
ALA B 162
TYR B 289
HIS B 166
 None
 1.30A 1qabE-2yaxB:
0.0		 1qabE-2yaxB:
20.57
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.
3bxv SULFUR
OXYGENASE/REDUCTASE

(Acidianus
tengchongensis) 		PF07682
(SOR) 		5 PHE A  54
LEU A  52
ALA A 162
TYR A 289
HIS A 166
 None
 1.29A 1qabE-3bxvA:
0.0		 1qabE-3bxvA:
19.22
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.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 LEU A 200
ALA A 231
VAL A 173
LEU A  47
HIS A  19
 None
 1.25A 1qabE-3dlaA:
undetectable		 1qabE-3dlaA:
13.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fmz RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		6 ALA A  57
MET A  88
TYR A  90
GLN A  98
HIS A 104
TYR A 133
 2T1  A 184 (-3.6A)
2T1  A 184 (-3.1A)
2T1  A 184 (-3.8A)
2T1  A 184 (-3.0A)
2T1  A 184 (-3.7A)
2T1  A 184 (-4.7A)
 1.12A 1qabE-3fmzA:
25.5		 1qabE-3fmzA:
83.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fmz RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		5 MET A  73
MET A  88
TYR A  90
GLN A  98
HIS A 104
 2T1  A 184 (-3.6A)
2T1  A 184 (-3.1A)
2T1  A 184 (-3.8A)
2T1  A 184 (-3.0A)
2T1  A 184 (-3.7A)
 1.27A 1qabE-3fmzA:
25.5		 1qabE-3fmzA:
83.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fmz RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		5 PHE A  36
ALA A  43
MET A  88
HIS A 104
TYR A 133
 2T1  A 184 (-3.7A)
2T1  A 184 ( 4.7A)
2T1  A 184 (-3.1A)
2T1  A 184 (-3.7A)
2T1  A 184 (-4.7A)
 1.10A 1qabE-3fmzA:
25.5		 1qabE-3fmzA:
83.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fmz RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		8 PHE A  36
LEU A  37
ALA A  57
VAL A  61
MET A  88
TYR A  90
HIS A 104
TYR A 133
 2T1  A 184 (-3.7A)
2T1  A 184 (-3.6A)
2T1  A 184 (-3.6A)
None
2T1  A 184 (-3.1A)
2T1  A 184 (-3.8A)
2T1  A 184 (-3.7A)
2T1  A 184 (-4.7A)
 0.97A 1qabE-3fmzA:
25.5		 1qabE-3fmzA:
83.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fmz RETINOL-BINDING
PROTEIN 4

(Homo sapiens) 		PF00061
(Lipocalin) 		7 PHE A  36
LEU A  37
VAL A  61
MET A  73
MET A  88
TYR A  90
HIS A 104
 2T1  A 184 (-3.7A)
2T1  A 184 (-3.6A)
None
2T1  A 184 (-3.6A)
2T1  A 184 (-3.1A)
2T1  A 184 (-3.8A)
2T1  A 184 (-3.7A)
 1.00A 1qabE-3fmzA:
25.5		 1qabE-3fmzA:
83.49
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.
3h4l DNA MISMATCH REPAIR
PROTEIN PMS1

(Saccharomyces
cerevisiae) 		PF01119
(DNA_mis_repair)
PF13589
(HATPase_c_3) 		5 LEU A  62
ALA A  58
VAL A 176
LEU A 131
TYR A 210
 None
None
None
ANP  A 397 (-3.9A)
None
 1.37A 1qabE-3h4lA:
undetectable		 1qabE-3h4lA:
17.69
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.
3hkl MUSCLE, SKELETAL
RECEPTOR TYROSINE
PROTEIN KINASE

(Rattus
norvegicus) 		PF01392
(Fz) 		5 PHE A 379
LEU A 378
ALA A 355
LEU A 373
TYR A 320
 None
 1.27A 1qabE-3hklA:
undetectable		 1qabE-3hklA:
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.
3k2b GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 LEU A 154
ALA A 210
VAL A 158
HIS A 176
TYR A 311
 None
SO4  A 337 (-3.3A)
None
None
None
 1.34A 1qabE-3k2bA:
undetectable		 1qabE-3k2bA:
18.99
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.
3ksk TYPE-2 RESTRICTION
ENZYME PVUII

(Proteus hauseri) 		PF09225
(Endonuc-PvuII) 		5 LEU A  10
TYR A 179
LEU A 204
GLN A 201
HIS A  15
 None
 1.50A 1qabE-3kskA:
undetectable		 1qabE-3kskA:
17.88
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.
3ksk TYPE-2 RESTRICTION
ENZYME PVUII

(Proteus hauseri) 		PF09225
(Endonuc-PvuII) 		5 LEU A 170
TYR A  19
LEU A  44
GLN A  41
HIS A 175
 None
 1.49A 1qabE-3kskA:
undetectable		 1qabE-3kskA:
17.88
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.
3mn8 LP15968P

(Drosophila
melanogaster) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		5 PHE A 216
LEU A 110
VAL A 106
TYR A 255
TYR A  96
 None
 1.40A 1qabE-3mn8A:
undetectable		 1qabE-3mn8A:
17.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pfe SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Legionella
pneumophila) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 LEU A  78
VAL A  70
MET A 419
LEU A 175
TYR A  94
 None
None
GOL  A 520 ( 3.8A)
None
None
 1.49A 1qabE-3pfeA:
undetectable		 1qabE-3pfeA:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rv6 ISOCHORISMATE
SYNTHASE/ISOCHORISMA
TE-PYRUVATE LYASE
MBTI

(Mycobacterium
tuberculosis) 		PF00425
(Chorismate_bind) 		5 LEU A 398
ALA A 352
VAL A 390
MET A 350
LEU A  92
 None
 1.09A 1qabE-3rv6A:
undetectable		 1qabE-3rv6A:
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.
3snx PUTATIVE SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 LEU A 229
ALA A 147
VAL A 225
LEU A 207
GLN A 204
 None
 1.50A 1qabE-3snxA:
undetectable		 1qabE-3snxA:
18.00
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.
3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Vibrio cholerae) 		PF00275
(EPSP_synthase) 		5 PHE A 173
LEU A 129
ALA A 103
MET A 121
GLN A 172
 None
None
None
None
CL  A   1 ( 4.6A)
 1.27A 1qabE-3ti2A:
undetectable		 1qabE-3ti2A:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tzg HYPOTHETICAL PROTEIN
BVU_2266

(Bacteroides
vulgatus) 		no annotation 5 LEU A 267
ALA A 188
VAL A  34
LEU A 209
TYR A 242
 None
 1.50A 1qabE-3tzgA:
undetectable		 1qabE-3tzgA:
21.29
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.
4b9a PROBABLE EPOXIDE
HYDROLASE

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		5 PHE A 101
LEU A  34
VAL A  60
LEU A  15
HIS A 120
 None
None
None
None
SO4  A1305 (-4.2A)
 1.44A 1qabE-4b9aA:
undetectable		 1qabE-4b9aA:
21.75
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.
4bg2 PATF

(Prochloron
didemni) 		no annotation 5 PHE A 245
MET A 136
LEU A 191
HIS A 125
TYR A 300
 None
 1.46A 1qabE-4bg2A:
2.2		 1qabE-4bg2A:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bwe GLYPICAN-1

(Homo sapiens) 		PF01153
(Glypican) 		5 PHE A 141
LEU A 321
ALA A 324
VAL A 317
LEU A 163
 None
 1.45A 1qabE-4bweA:
undetectable		 1qabE-4bweA:
17.40
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.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		5 PHE B 248
LEU A 322
ALA B 252
MET B 124
LEU B 343
 None
 1.06A 1qabE-4cakB:
undetectable		 1qabE-4cakB:
13.17
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		5 PHE L 258
LEU L 259
ALA L 205
VAL L 262
TYR L 180
 None
 1.16A 1qabE-4heaL:
undetectable		 1qabE-4heaL:
15.03
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.
4rkz PUTATIVE
UNCHARACTERIZED
PROTEIN TA1305

(Thermoplasma
acidophilum) 		no annotation 5 LEU A 135
ALA A 117
VAL A 138
TYR A  81
LEU A  78
 None
 1.41A 1qabE-4rkzA:
undetectable		 1qabE-4rkzA:
19.41
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.
4xvh CARBOHYDRATE
ESTERASE FAMILY 2
(CE2)

(Chaetomium) 		PF13472
(Lipase_GDSL_2) 		5 LEU A 235
MET A 258
TYR A 254
LEU A 276
GLN A 297
 None
 1.33A 1qabE-4xvhA:
undetectable		 1qabE-4xvhA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ydk HEAVY CHAIN OF
ANTIBODY
C38-VRC16.01
LIGHT CHAIN OF
ANTIBODY
C38-VRC16.01

(Homo sapiens;
Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
PF07654
(C1-set)
PF07686
(V-set) 		5 VAL H  50
TYR L  36
GLN L  89
HIS L  55
TYR H 100
 None
 1.42A 1qabE-4ydkH:
undetectable		 1qabE-4ydkH:
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.
4zwn MONOGLYCERIDE LIPASE

(Saccharomyces
cerevisiae) 		PF12146
(Hydrolase_4) 		5 PHE A 198
LEU A 199
TYR A  52
LEU A 208
TYR A   4
 None
 1.41A 1qabE-4zwnA:
undetectable		 1qabE-4zwnA:
18.60
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.
5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN

(Mycobacterium
tuberculosis) 		PF01152
(Bac_globin) 		5 PHE A  32
LEU A  98
MET A  77
LEU A  66
HIS A  81
 FMT  A1129 ( 4.9A)
None
HEM  A 144 (-3.5A)
None
HEM  A 144 ( 3.2A)
 1.41A 1qabE-5ab8A:
undetectable		 1qabE-5ab8A:
20.44
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.
5amq RNA POLYMERASE L

(California
encephalitis
orthobunyavirus) 		PF04196
(Bunya_RdRp)
PF15518
(L_protein_N) 		5 PHE A1111
LEU A1114
ALA A 899
MET A 900
TYR A 903
 None
 1.37A 1qabE-5amqA:
undetectable		 1qabE-5amqA:
5.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d8g TRYPTOPHANASE

(Escherichia
coli) 		PF01212
(Beta_elim_lyase) 		5 LEU A 322
ALA A 268
VAL A  87
MET A 266
LEU A 264
 None
 1.22A 1qabE-5d8gA:
undetectable		 1qabE-5d8gA:
15.09
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.
5dgt BENZOYLFORMATE
DECARBOXYLASE

(Pseudomonas
putida) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 LEU A 227
ALA A 200
VAL A 329
LEU A 193
HIS A 267
 None
 1.47A 1qabE-5dgtA:
undetectable		 1qabE-5dgtA:
16.73
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.
5f0k VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 35

(Homo sapiens) 		PF03635
(Vps35) 		5 PHE A  85
LEU A  81
ALA A  42
VAL A 114
LEU A  97
 None
None
None
None
EDO  A 501 (-4.7A)
 1.44A 1qabE-5f0kA:
undetectable		 1qabE-5f0kA:
16.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5szr PROTEIN PCDHGB2

(Mus musculus) 		PF00028
(Cadherin) 		5 PHE A 545
LEU A 630
ALA A 628
VAL A 596
TYR A 534
 None
 1.47A 1qabE-5szrA:
undetectable		 1qabE-5szrA:
17.16
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.
5tdx ANCESTRAL
HYDROXYNITRILE LYASE
1

(synthetic
construct) 		no annotation 5 PHE A 210
TYR A 201
LEU A 216
GLN A 218
HIS A 103
 None
 1.49A 1qabE-5tdxA:
undetectable		 1qabE-5tdxA:
19.63
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.
6byx SHORT ULVAN LYASE

(Alteromonas sp.
LOR) 		no annotation 5 LEU A 360
ALA A 337
TYR A 335
LEU A 302
GLN A 319
 None
 1.38A 1qabE-6byxA:
undetectable		 1qabE-6byxA:
undetectable