SIMILAR PATTERNS OF AMINO ACIDS FOR 5HW8_B_FK5B201_1

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.
1fd9 PROTEIN (MACROPHAGE
INFECTIVITY
POTENTIATOR PROTEIN)

(Legionella
pneumophila) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		6 ASP A 142
PHE A 153
TRP A 162
TYR A 185
ILE A 194
PHE A 202
 None
 1.14A 5hw8B-1fd9A:
15.7		 5hw8B-1fd9A:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fd9 PROTEIN (MACROPHAGE
INFECTIVITY
POTENTIATOR PROTEIN)

(Legionella
pneumophila) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		7 TYR A 131
ASP A 142
VAL A 158
TRP A 162
TYR A 185
ILE A 194
PHE A 202
 None
 0.59A 5hw8B-1fd9A:
15.7		 5hw8B-1fd9A:
23.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fkk FK506 BINDING
PROTEIN

(Bos taurus) 		PF00254
(FKBP_C) 		9 TYR A  26
ASP A  37
ARG A  42
PHE A  46
VAL A  55
TRP A  59
TYR A  82
ILE A  91
PHE A  99
 None
 0.69A 5hw8B-1fkkA:
18.8		 5hw8B-1fkkA:
45.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fkk FK506 BINDING
PROTEIN

(Bos taurus) 		PF00254
(FKBP_C) 		9 TYR A  26
ASP A  37
PHE A  46
VAL A  55
TRP A  59
TYR A  82
ILE A  90
ILE A  91
PHE A  99
 None
 0.54A 5hw8B-1fkkA:
18.8		 5hw8B-1fkkA:
45.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1fkk FK506 BINDING
PROTEIN

(Bos taurus) 		PF00254
(FKBP_C) 		7 TYR A  26
PHE A  46
VAL A  55
TRP A  59
ILE A  90
ILE A  91
PHE A  99
 None
 1.44A 5hw8B-1fkkA:
18.8		 5hw8B-1fkkA:
45.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		5 PHE A 114
TRP A 123
TYR A 146
ILE A 155
PHE A 163
 None
 1.10A 5hw8B-1jvwA:
15.0		 5hw8B-1jvwA:
32.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		7 TYR A  92
ARG A 108
VAL A 119
TRP A 123
TYR A 146
ILE A 155
PHE A 163
 None
 0.66A 5hw8B-1jvwA:
15.0		 5hw8B-1jvwA:
32.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		7 TYR A  92
ASP A 103
ARG A 108
TRP A 123
TYR A 146
ILE A 155
PHE A 163
 None
 0.70A 5hw8B-1jvwA:
15.0		 5hw8B-1jvwA:
32.47
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.
1kt1 FK506-BINDING
PROTEIN FKBP51

(Saimiri
boliviensis) 		PF00254
(FKBP_C)
PF00515
(TPR_1)
PF13181
(TPR_8) 		5 TYR A  57
PHE A  77
TRP A  90
ILE A 122
PHE A 130
 None
 0.93A 5hw8B-1kt1A:
14.4		 5hw8B-1kt1A:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kt1 FK506-BINDING
PROTEIN FKBP51

(Saimiri
boliviensis) 		PF00254
(FKBP_C)
PF00515
(TPR_1)
PF13181
(TPR_8) 		6 TYR A  57
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
 None
 1.46A 5hw8B-1kt1A:
14.4		 5hw8B-1kt1A:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kt1 FK506-BINDING
PROTEIN FKBP51

(Saimiri
boliviensis) 		PF00254
(FKBP_C)
PF00515
(TPR_1)
PF13181
(TPR_8) 		7 TYR A  57
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.91A 5hw8B-1kt1A:
14.4		 5hw8B-1kt1A:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lme PEPTIDE DEFORMYLASE

(Thermotoga
maritima) 		PF01327
(Pep_deformylase) 		5 ARG A 125
VAL A 137
ILE A  73
ILE A 103
ILE A  76
 None
 1.35A 5hw8B-1lmeA:
undetectable		 5hw8B-1lmeA:
22.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1n1a FKBP52

(Homo sapiens) 		PF00254
(FKBP_C) 		5 TYR A  57
ASP A  68
PHE A  77
VAL A  86
ILE A 122
 None
 1.22A 5hw8B-1n1aA:
16.5		 5hw8B-1n1aA:
36.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1n1a FKBP52

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
ASP A  68
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.52A 5hw8B-1n1aA:
16.5		 5hw8B-1n1aA:
36.49
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.
1ox4 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
HISHF

(Saccharomyces
cerevisiae) 		PF00117
(GATase)
PF00977
(His_biosynth) 		5 PHE B  61
TYR B 104
ILE B  73
ILE B  79
ILE B 187
 None
 1.32A 5hw8B-1ox4B:
undetectable		 5hw8B-1ox4B:
13.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pbk FKBP25

(Homo sapiens) 		PF00254
(FKBP_C) 		7 TYR A 135
ASP A 146
VAL A 171
TRP A 175
TYR A 198
ILE A 208
PHE A 216
 RAP  A 225 (-3.9A)
RAP  A 225 (-3.0A)
RAP  A 225 (-3.5A)
RAP  A 225 (-3.4A)
RAP  A 225 (-4.6A)
RAP  A 225 ( 4.9A)
None
 0.40A 5hw8B-1pbkA:
17.9		 5hw8B-1pbkA:
40.00
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.
1q6h FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKPA

(Escherichia
coli) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		8 TYR A 146
ASP A 157
ARG A 162
VAL A 173
TRP A 177
TYR A 200
ILE A 208
PHE A 216
 None
 0.64A 5hw8B-1q6hA:
15.6		 5hw8B-1q6hA:
25.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r9h FK506 BINDING
PROTEIN FAMILY

(Caenorhabditis
elegans) 		PF00254
(FKBP_C) 		9 TYR A  40
ASP A  51
ARG A  56
PHE A  60
VAL A  69
TRP A  73
TYR A  96
ILE A 105
PHE A 113
 None
 0.66A 5hw8B-1r9hA:
18.1		 5hw8B-1r9hA:
34.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1u79 FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
3

(Arabidopsis
thaliana) 		PF00254
(FKBP_C) 		6 TYR A  37
ASP A  48
ARG A  53
TYR A  99
ILE A 113
PHE A 121
 None
 1.17A 5hw8B-1u79A:
18.1		 5hw8B-1u79A:
40.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1u79 FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
3

(Arabidopsis
thaliana) 		PF00254
(FKBP_C) 		7 TYR A  37
ASP A  48
VAL A  66
TRP A  70
TYR A  99
ILE A 113
PHE A 121
 None
 0.49A 5hw8B-1u79A:
18.1		 5hw8B-1u79A:
40.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1yat FK506 BINDING
PROTEIN

(Saccharomyces
cerevisiae) 		PF00254
(FKBP_C) 		9 TYR A  26
ASP A  37
ARG A  42
PHE A  46
VAL A  55
TRP A  59
TYR A  82
ILE A  91
PHE A  99
 FK5  A 108 ( 4.0A)
FK5  A 108 ( 3.3A)
FK5  A 108 (-3.7A)
FK5  A 108 ( 4.0A)
FK5  A 108 ( 3.4A)
FK5  A 108 ( 3.6A)
FK5  A 108 ( 4.7A)
None
None
 0.51A 5hw8B-1yatA:
19.6		 5hw8B-1yatA:
55.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z9a NAD(P)H-DEPENDENT
D-XYLOSE REDUCTASE

([Candida]
tenuis) 		PF00248
(Aldo_ket_red) 		5 ASP A 314
ARG A 232
PHE A 225
ILE A 320
ILE A 318
 None
 1.21A 5hw8B-1z9aA:
undetectable		 5hw8B-1z9aA:
16.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cir HEXOSE-6-PHOSPHATE
MUTAROTASE

(Saccharomyces
cerevisiae) 		PF01263
(Aldose_epim) 		5 ASP A 219
VAL A 195
ILE A 261
ILE A 164
ILE A 167
 None
 1.30A 5hw8B-2cirA:
undetectable		 5hw8B-2cirA:
16.56
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.
2dry 29-KDA
GALACTOSE-BINDING
LECTIN

(Lumbricus
terrestris) 		PF00652
(Ricin_B_lectin) 		5 PHE A 134
VAL A 214
ILE A 198
ILE A 158
ILE A 242
 None
 0.92A 5hw8B-2dryA:
undetectable		 5hw8B-2dryA:
25.17
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.
2g0b FEEM

(uncultured
bacterium) 		no annotation 5 ASP A  75
ARG A  86
VAL A  96
TYR A 163
ILE A  77
 None
None
NLT  A 400 (-3.4A)
None
None
 1.33A 5hw8B-2g0bA:
undetectable		 5hw8B-2g0bA:
21.67
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.
2hjg GTP-BINDING PROTEIN
ENGA

(Bacillus
subtilis) 		PF01926
(MMR_HSR1)
PF14714
(KH_dom-like) 		5 TYR A 384
ASP A 132
VAL A 388
ILE A 130
PHE A 398
 None
 1.23A 5hw8B-2hjgA:
undetectable		 5hw8B-2hjgA:
15.02
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.
2i7x PROTEIN CFT2

(Saccharomyces
cerevisiae) 		PF16661
(Lactamase_B_6) 		5 ASP A 410
VAL A 345
ILE A 353
ILE A 409
ILE A 354
 None
 1.30A 5hw8B-2i7xA:
undetectable		 5hw8B-2i7xA:
12.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2lpv FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Aedes aegypti) 		PF00254
(FKBP_C) 		5 TYR A  27
PHE A  47
VAL A  56
TRP A  60
ILE A  92
 None
 1.00A 5hw8B-2lpvA:
16.2		 5hw8B-2lpvA:
46.67
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.
2nyf NOSTOC PUNCTIFORME
PHENYLALANINE
AMMONIA LYASE

(Nostoc
punctiforme) 		PF00221
(Lyase_aromatic) 		5 TYR A 475
VAL A 249
ILE A 323
ILE A 326
PHE A 472
 None
 1.35A 5hw8B-2nyfA:
undetectable		 5hw8B-2nyfA:
13.62
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.
2p9x HYPOTHETICAL PROTEIN
PH0832

(Pyrococcus
horikoshii) 		PF11537
(DUF3227) 		5 PHE A  57
VAL A  26
ILE A  39
ILE A  12
ILE A  13
 None
 1.27A 5hw8B-2p9xA:
undetectable		 5hw8B-2p9xA:
19.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pbc FK506-BINDING
PROTEIN 2

(Homo sapiens) 		PF00254
(FKBP_C) 		5 TYR A  56
ASP A  67
PHE A  76
VAL A  85
ILE A 121
 PEG  A 201 (-4.4A)
None
PEG  A 201 ( 3.9A)
PEG  A 201 (-3.6A)
None
 1.03A 5hw8B-2pbcA:
15.3		 5hw8B-2pbcA:
44.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pbc FK506-BINDING
PROTEIN 2

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  56
ASP A  67
PHE A  76
VAL A  85
TRP A  89
TYR A 112
ILE A 121
PHE A 129
 PEG  A 201 (-4.4A)
None
PEG  A 201 ( 3.9A)
PEG  A 201 (-3.6A)
PEG  A 201 (-3.7A)
None
None
None
 0.73A 5hw8B-2pbcA:
15.3		 5hw8B-2pbcA:
44.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2vcd OUTER MEMBRANE
PROTEIN MIP

(Legionella
pneumophila) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		5 TYR A  55
ASP A  66
VAL A  82
TRP A  86
TYR A 109
 RAP  A 138 (-2.6A)
RAP  A 138 (-2.7A)
RAP  A 138 (-3.2A)
RAP  A 138 (-2.3A)
RAP  A 138 (-3.8A)
 0.92A 5hw8B-2vcdA:
13.2		 5hw8B-2vcdA:
34.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2vn1 70 KDA
PEPTIDYLPROLYL
ISOMERASE

(Plasmodium
falciparum) 		PF00254
(FKBP_C) 		9 TYR A  44
ASP A  56
ARG A  61
PHE A  65
VAL A  74
TRP A  78
TYR A 101
ILE A 110
PHE A 118
 FK5  A 501 (-4.1A)
FK5  A 501 (-3.4A)
FK5  A 501 (-3.9A)
FK5  A 501 (-4.1A)
FK5  A 501 (-3.5A)
FK5  A 501 (-3.3A)
FK5  A 501 (-4.7A)
None
FK5  A 501 (-4.8A)
 0.59A 5hw8B-2vn1A:
17.6		 5hw8B-2vn1A:
33.09
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.
2vxz PYRSV_GP04

(Pyrobaculum
spherical virus) 		no annotation 5 ASP A 107
ARG A  85
ILE A 120
ILE A 104
ILE A 105
 None
 1.26A 5hw8B-2vxzA:
undetectable		 5hw8B-2vxzA:
19.14
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.
2ww8 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF13519
(VWA_2) 		5 PHE A 358
VAL A 441
TYR A 503
ILE A 396
ILE A 512
 None
 1.26A 5hw8B-2ww8A:
undetectable		 5hw8B-2ww8A:
10.05
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.
2xde GAG POLYPROTEIN

(Human
immunodeficiency
virus 1) 		PF00607
(Gag_p24) 		5 PHE A  32
VAL A  59
TRP A  23
ILE A  73
PHE A  40
 None
None
None
1B0  A1148 ( 4.1A)
None
 1.31A 5hw8B-2xdeA:
undetectable		 5hw8B-2xdeA:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2y78 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei) 		PF00254
(FKBP_C) 		9 TYR A  33
ASP A  44
ARG A  49
PHE A  53
VAL A  62
TRP A  66
TYR A  89
ILE A  98
PHE A 106
 None
 0.70A 5hw8B-2y78A:
17.2		 5hw8B-2y78A:
47.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3abi PUTATIVE
UNCHARACTERIZED
PROTEIN PH1688

(Pyrococcus
horikoshii) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		5 ASP A  18
ARG A 342
ILE A  66
ILE A  15
ILE A   5
 None
 1.16A 5hw8B-3abiA:
undetectable		 5hw8B-3abiA:
14.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b7x FK506-BINDING
PROTEIN 6

(Homo sapiens) 		PF00254
(FKBP_C) 		5 TYR A  61
ASP A  73
TYR A 118
ILE A 127
PHE A 135
 None
 0.81A 5hw8B-3b7xA:
13.6		 5hw8B-3b7xA:
27.89
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.
3gse MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE

(Yersinia pestis) 		PF00425
(Chorismate_bind) 		5 TYR A 261
ASP A 350
ILE A  83
ILE A  94
PHE A 400
 None
 1.30A 5hw8B-3gseA:
undetectable		 5hw8B-3gseA:
13.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mtl CELL DIVISION
PROTEIN KINASE 16

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 445
VAL A 263
ILE A 462
ILE A 453
ILE A 468
 None
 1.04A 5hw8B-3mtlA:
undetectable		 5hw8B-3mtlA:
17.13
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.
3n6z PUTATIVE
IMMUNOGLOBULIN A1
PROTEASE

(Bacteroides
ovatus) 		no annotation 5 VAL A 126
ILE A 168
ILE A 186
ILE A 204
PHE A 377
 None
 1.22A 5hw8B-3n6zA:
undetectable		 5hw8B-3n6zA:
16.94
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.
3o2u NEDD8-CONJUGATING
ENZYME UBC12

(Saccharomyces
cerevisiae) 		PF00179
(UQ_con) 		5 ASP A1035
VAL A1049
ILE A1133
ILE A1132
PHE A1086
 None
GOL  A3968 ( 4.8A)
None
None
None
 1.26A 5hw8B-3o2uA:
undetectable		 5hw8B-3o2uA:
21.69
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.
3o5d PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
ASP A  68
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.78A 5hw8B-3o5dA:
17.1		 5hw8B-3o5dA:
27.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o5e PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		5 TYR A  57
ASP A  68
PHE A  77
VAL A  86
ILE A 122
 None
 1.29A 5hw8B-3o5eA:
17.1		 5hw8B-3o5eA:
39.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o5e PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		7 TYR A  57
ASP A  68
PHE A  77
VAL A  86
TYR A 113
ILE A 122
PHE A 130
 None
 0.80A 5hw8B-3o5eA:
17.1		 5hw8B-3o5eA:
39.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o5e PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		7 TYR A  57
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.86A 5hw8B-3o5eA:
17.1		 5hw8B-3o5eA:
39.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pa7 70 KDA
PEPTIDYLPROLYL
ISOMERASE, PUTATIVE

(Plasmodium
vivax) 		PF00254
(FKBP_C) 		9 TYR A  43
ASP A  55
ARG A  60
PHE A  64
VAL A  73
TRP A  77
TYR A 100
ILE A 109
PHE A 117
 None
 0.66A 5hw8B-3pa7A:
17.2		 5hw8B-3pa7A:
36.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pa7 70 KDA
PEPTIDYLPROLYL
ISOMERASE, PUTATIVE

(Plasmodium
vivax) 		PF00254
(FKBP_C) 		5 TYR A  43
ASP A  55
PHE A  64
VAL A  73
ILE A 109
 None
 1.24A 5hw8B-3pa7A:
17.2		 5hw8B-3pa7A:
36.43
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.
3r2u METALLO-BETA-LACTAMA
SE FAMILY PROTEIN

(Staphylococcus
aureus) 		PF00753
(Lactamase_B) 		5 ASP A  30
PHE A 126
VAL A  98
TYR A  88
ILE A  57
 None
 1.26A 5hw8B-3r2uA:
undetectable		 5hw8B-3r2uA:
15.14
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.
3tw0 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF00092
(VWA) 		5 PHE A 355
VAL A 435
TYR A 494
ILE A 393
ILE A 509
 None
 1.33A 5hw8B-3tw0A:
undetectable		 5hw8B-3tw0A:
17.92
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.
3zkj ANKYRIN REPEAT AND
SOCS BOX PROTEIN 9

(Homo sapiens) 		PF07525
(SOCS_box)
PF12796
(Ank_2) 		5 ARG A 267
VAL A 183
ILE A 160
ILE A 272
ILE A 154
 None
 1.22A 5hw8B-3zkjA:
undetectable		 5hw8B-3zkjA:
16.92
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.
4aw7 GH86A
BETA-PORPHYRANASE

(Bacteroides
plebeius) 		no annotation 5 TYR A 292
ASP A 294
ARG A 361
VAL A 325
ILE A 441
 None
 1.31A 5hw8B-4aw7A:
undetectable		 5hw8B-4aw7A:
12.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4bf8 FPR4

(Saccharomyces
cerevisiae) 		PF00254
(FKBP_C) 		6 TYR A 313
ASP A 324
PHE A 332
VAL A 341
TRP A 345
PHE A 384
 None
 0.86A 5hw8B-4bf8A:
15.2		 5hw8B-4bf8A:
37.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4bf8 FPR4

(Saccharomyces
cerevisiae) 		PF00254
(FKBP_C) 		7 TYR A 313
ASP A 324
VAL A 341
TRP A 345
TYR A 368
ILE A 376
PHE A 384
 None
 0.84A 5hw8B-4bf8A:
15.2		 5hw8B-4bf8A:
37.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dip PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP14

(Homo sapiens) 		PF00254
(FKBP_C) 		5 TYR A  52
TRP A  88
TYR A 111
ILE A 119
PHE A 127
 None
 0.55A 5hw8B-4dipA:
16.6		 5hw8B-4dipA:
34.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dz3 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei) 		PF00254
(FKBP_C) 		9 TYR A  33
ASP A  44
ARG A  49
PHE A  53
VAL A  62
TRP A  66
TYR A  89
ILE A  98
PHE A 106
 FK5  A 201 ( 3.9A)
FK5  A 201 (-3.5A)
FK5  A 201 ( 3.7A)
FK5  A 201 (-4.1A)
FK5  A 201 ( 3.6A)
FK5  A 201 (-3.4A)
FK5  A 201 (-4.7A)
None
FK5  A 201 (-4.8A)
 0.54A 5hw8B-4dz3A:
18.1		 5hw8B-4dz3A:
47.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gkv ALCOHOL
DEHYDROGENASE,
PROPANOL-PREFERRING

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ASP A 217
VAL A 246
TYR A 168
ILE A 192
ILE A 211
 None
 1.27A 5hw8B-4gkvA:
undetectable		 5hw8B-4gkvA:
17.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iqc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1B

(Homo sapiens) 		PF00254
(FKBP_C) 		6 TYR A  26
ARG A  42
PHE A  46
VAL A  55
TYR A  82
PHE A  99
 None
 0.94A 5hw8B-4iqcA:
18.7		 5hw8B-4iqcA:
46.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iqc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1B

(Homo sapiens) 		PF00254
(FKBP_C) 		6 TYR A  26
ASP A  37
ARG A  42
PHE A  46
TYR A  82
PHE A  99
 None
 0.79A 5hw8B-4iqcA:
18.7		 5hw8B-4iqcA:
46.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iqc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1B

(Homo sapiens) 		PF00254
(FKBP_C) 		6 TYR A  26
ASP A  37
PHE A  46
TYR A  82
ILE A  91
PHE A  99
 None
 0.72A 5hw8B-4iqcA:
18.7		 5hw8B-4iqcA:
46.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iqc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1B

(Homo sapiens) 		PF00254
(FKBP_C) 		6 TYR A  26
PHE A  46
VAL A  55
TYR A  82
ILE A  91
PHE A  99
 None
 0.84A 5hw8B-4iqcA:
18.7		 5hw8B-4iqcA:
46.72
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.
4jcl CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Paenibacillus
macerans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 TYR A 100
ASP A 135
ARG A 227
ILE A  20
ILE A  76
 GOL  A 711 ( 4.0A)
EDO  A 718 (-3.1A)
EDO  A 718 ( 4.8A)
None
None
 1.23A 5hw8B-4jclA:
undetectable		 5hw8B-4jclA:
9.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4law PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP4

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
ARG A  73
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
None
None
DMS  A 304 (-3.5A)
DMS  A 304 ( 4.0A)
None
None
DMS  A 304 (-4.3A)
 0.92A 5hw8B-4lawA:
17.7		 5hw8B-4lawA:
27.18
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.
4law PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP4

(Homo sapiens) 		PF00254
(FKBP_C) 		5 TYR A  57
ASP A  68
PHE A  77
VAL A  86
ILE A 122
 None
None
None
DMS  A 304 (-3.5A)
None
 1.12A 5hw8B-4lawA:
17.7		 5hw8B-4lawA:
27.18
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.
4law PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP4

(Homo sapiens) 		PF00254
(FKBP_C) 		7 TYR A  57
ASP A  68
PHE A  77
VAL A  86
TRP A  90
ILE A 122
PHE A 130
 None
None
None
DMS  A 304 (-3.5A)
DMS  A 304 ( 4.0A)
None
DMS  A 304 (-4.3A)
 0.69A 5hw8B-4lawA:
17.7		 5hw8B-4lawA:
27.18
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.
4msp PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP14

(Homo sapiens) 		PF00254
(FKBP_C)
PF13499
(EF-hand_7) 		5 TYR A  33
TRP A  69
TYR A  92
ILE A 100
PHE A 108
 None
 0.46A 5hw8B-4mspA:
17.4		 5hw8B-4mspA:
26.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nnr PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP2

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  56
ASP A  67
PHE A  76
VAL A  85
TRP A  89
TYR A 112
ILE A 121
PHE A 129
 FK5  A 201 (-4.1A)
FK5  A 201 (-3.4A)
FK5  A 201 (-4.0A)
FK5  A 201 (-3.4A)
FK5  A 201 (-3.5A)
FK5  A 201 (-4.5A)
None
FK5  A 201 (-4.9A)
 0.37A 5hw8B-4nnrA:
15.4		 5hw8B-4nnrA:
36.00
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.
4odr PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A CHIMERA

(Homo sapiens;
Thermus
thermophilus) 		PF00254
(FKBP_C) 		6 TYR A  13
ASP A  23
TYR A  63
ILE A  71
ILE A  72
PHE A  80
 FK5  A 201 ( 3.6A)
FK5  A 201 (-3.6A)
FK5  A 201 (-4.4A)
FK5  A 201 ( 4.1A)
None
FK5  A 201 ( 4.8A)
 0.55A 5hw8B-4odrA:
12.5		 5hw8B-4odrA:
26.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r0x PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
ARG A  73
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.75A 5hw8B-4r0xA:
17.7		 5hw8B-4r0xA:
40.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r0x PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
ASP A  68
ARG A  73
PHE A  77
VAL A  86
TRP A  90
TYR A 113
PHE A 130
 None
 0.79A 5hw8B-4r0xA:
17.7		 5hw8B-4r0xA:
40.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5b8i PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Coccidioides
immitis) 		PF00254
(FKBP_C) 		9 TYR C  36
ASP C  56
ARG C  61
PHE C  64
VAL C  73
TRP C  77
TYR C 100
ILE C 109
PHE C 117
 FK5  C 201 (-4.1A)
FK5  C 201 ( 3.8A)
FK5  C 201 (-3.8A)
FK5  C 201 (-3.8A)
FK5  C 201 (-3.5A)
FK5  C 201 (-3.4A)
FK5  C 201 (-4.5A)
None
FK5  C 201 (-4.7A)
 0.62A 5hw8B-5b8iC:
19.1		 5hw8B-5b8iC:
37.86
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.
5dok TELOMERASE
ASSOCIATED PROTEIN
P45

(Tetrahymena
thermophila) 		no annotation 5 ASP A 239
ARG A 191
TYR A 258
ILE A 262
ILE A 236
 None
MG  A 401 (-4.7A)
None
None
None
 1.17A 5hw8B-5dokA:
undetectable		 5hw8B-5dokA:
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.
5exe OXALATE
OXIDOREDUCTASE
SUBUNIT BETA

(Moorella
thermoacetica) 		PF02775
(TPP_enzyme_C) 		5 ASP C 177
ARG C 299
PHE C 249
TYR C 218
ILE C 182
 None
 1.30A 5hw8B-5exeC:
undetectable		 5hw8B-5exeC:
17.12
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.
5h0k UNCHARACTERIZED
PROTEIN

(Pedobacter
heparinus) 		PF16265
(DUF4918) 		5 TYR A  46
TYR A 104
ILE A 103
ILE A 107
PHE A  45
 None
 1.30A 5hw8B-5h0kA:
undetectable		 5hw8B-5h0kA:
18.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i7p PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A,FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A

(Escherichia
coli;
Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  26
ASP A  37
ARG A  42
PHE A  46
VAL A  55
TRP A  59
TYR A  82
PHE A 146
 None
 0.67A 5hw8B-5i7pA:
17.1		 5hw8B-5i7pA:
32.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i7q PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A,FKBP-TYPE 16
KDA PEPTIDYL-PROLYL
CIS-TRANS
ISOMERASE,PEPTIDYL-P
ROLYL CIS-TRANS
ISOMERASE FKBP1A

(Escherichia
coli;
Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  26
ASP A  37
ARG A  42
PHE A  46
VAL A  55
TRP A  59
TYR A  82
PHE A 147
 None
 0.62A 5hw8B-5i7qA:
17.4		 5hw8B-5i7qA:
32.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i98 FK506-BINDING
PROTEIN 1

(Candida
albicans) 		PF00254
(FKBP_C) 		6 TYR A  30
ARG A  46
PHE A  50
TRP A  63
ILE A 105
PHE A 114
 None
 1.10A 5hw8B-5i98A:
24.7		 5hw8B-5i98A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i98 FK506-BINDING
PROTEIN 1

(Candida
albicans) 		PF00254
(FKBP_C) 		7 TYR A  30
ARG A  46
PHE A  50
VAL A  59
TRP A  63
TYR A  97
ILE A 102
 None
 1.24A 5hw8B-5i98A:
24.7		 5hw8B-5i98A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i98 FK506-BINDING
PROTEIN 1

(Candida
albicans) 		PF00254
(FKBP_C) 		8 TYR A  30
ARG A  46
PHE A  50
VAL A  59
TRP A  63
TYR A  97
ILE A 102
PHE A 114
 None
 0.78A 5hw8B-5i98A:
24.7		 5hw8B-5i98A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i98 FK506-BINDING
PROTEIN 1

(Candida
albicans) 		PF00254
(FKBP_C) 		10 TYR A  30
ASP A  41
PHE A  50
VAL A  59
TRP A  63
TYR A  97
ILE A 102
ILE A 105
ILE A 106
PHE A 114
 None
 0.51A 5hw8B-5i98A:
24.7		 5hw8B-5i98A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i98 FK506-BINDING
PROTEIN 1

(Candida
albicans) 		PF00254
(FKBP_C) 		7 TYR A  30
PHE A  50
VAL A  59
TRP A  63
ILE A 102
ILE A 106
PHE A 114
 None
 1.17A 5hw8B-5i98A:
24.7		 5hw8B-5i98A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5j6e FK506-BINDING
PROTEIN 1A

(Aspergillus
fumigatus) 		PF00254
(FKBP_C) 		9 TYR A  27
ASP A  38
ARG A  43
PHE A  47
VAL A  56
TRP A  60
TYR A  83
ILE A  92
PHE A 100
 None
 0.63A 5hw8B-5j6eA:
20.0		 5hw8B-5j6eA:
46.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5j6e FK506-BINDING
PROTEIN 1A

(Aspergillus
fumigatus) 		PF00254
(FKBP_C) 		5 TYR A  27
ASP A  38
PHE A  47
VAL A  56
ILE A  92
 None
 1.25A 5hw8B-5j6eA:
20.0		 5hw8B-5j6eA:
46.72
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.
5lxv SCAFFOLDIN C

(Ruminococcus
flavefaciens) 		PF00963
(Cohesin) 		5 ASP A  51
VAL A  47
TYR A  43
ILE A  80
PHE A  20
 None
 1.29A 5hw8B-5lxvA:
undetectable		 5hw8B-5lxvA:
22.40
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 TYR A 559
ASP A 634
PHE A 574
VAL A 535
ILE A 519
 None
 1.21A 5hw8B-5m5pA:
undetectable		 5hw8B-5m5pA:
5.61
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.
5ol6 NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE,D
NA-DIRECTED DNA
POLYMERASE

(Nostoc
punctiforme) 		no annotation 5 ASP A  17
ARG A  92
ILE A  63
ILE A  60
ILE A  50
 None
 1.17A 5hw8B-5ol6A:
undetectable		 5hw8B-5ol6A:
21.68
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.
5tv2 ELONGATION FACTOR G

(Vibrio
vulnificus) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2) 		5 ASP A 291
ARG A 253
VAL A  84
ILE A   7
ILE A 290
 None
 1.29A 5hw8B-5tv2A:
undetectable		 5hw8B-5tv2A:
17.92
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.
5u4o ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Bacillus
anthracis) 		PF00496
(SBP_bac_5) 		5 PHE A 363
VAL A 300
ILE A 308
ILE A 382
ILE A 286
 None
 1.25A 5hw8B-5u4oA:
undetectable		 5hw8B-5u4oA:
12.19
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.
5v8t UBIQUITIN-LIKE
PROTEIN
SMT3,PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei;
Saccharomyces
cerevisiae) 		no annotation 9 TYR A  33
ASP A  44
ARG A  49
PHE A  53
VAL A  62
TRP A  66
TYR A  89
ILE A  98
PHE A 106
 8ZV  A 201 (-3.8A)
8ZV  A 201 (-3.9A)
8ZV  A 201 (-3.6A)
8ZV  A 201 (-3.9A)
8ZV  A 201 (-3.6A)
8ZV  A 201 (-3.3A)
8ZV  A 201 (-4.6A)
8ZV  A 201 ( 4.8A)
8ZV  A 201 (-4.6A)
 0.55A 5hw8B-5v8tA:
18.0		 5hw8B-5v8tA:
19.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w63 APOPTOSIS REGULATOR
BAX

(Ictalurus
punctatus) 		no annotation 5 VAL A  20
ILE A  14
ILE A 148
ILE A 151
PHE A 113
 None
 1.32A 5hw8B-5w63A:
undetectable		 5hw8B-5w63A:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wtk CRISPR-ASSOCIATED
ENDORIBONUCLEASE
C2C2

(Leptotrichia
shahii) 		no annotation 5 ASP A 646
PHE A 798
VAL A 702
ILE A 821
ILE A 651
 None
 1.35A 5hw8B-5wtkA:
undetectable		 5hw8B-5wtkA:
6.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xb0 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00254
(FKBP_C) 		5 PHE A 166
TRP A 175
TYR A 198
ILE A 207
PHE A 215
 TLA  A 301 ( 4.6A)
TLA  A 301 (-3.4A)
None
None
None
 1.14A 5hw8B-5xb0A:
15.1		 5hw8B-5xb0A:
27.94
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.
5xb0 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00254
(FKBP_C) 		7 TYR A 147
ASP A 158
VAL A 171
TRP A 175
TYR A 198
ILE A 207
PHE A 215
 TLA  A 301 ( 4.4A)
TLA  A 301 (-3.7A)
TLA  A 301 (-3.4A)
TLA  A 301 (-3.4A)
None
None
None
 0.63A 5hw8B-5xb0A:
15.1		 5hw8B-5xb0A:
27.94
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.
5xb0 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00254
(FKBP_C) 		5 TYR A 147
VAL A 171
TRP A 175
ILE A 207
PHE A 215
 TLA  A 301 ( 4.4A)
TLA  A 301 (-3.4A)
TLA  A 301 (-3.4A)
None
None
 1.22A 5hw8B-5xb0A:
15.1		 5hw8B-5xb0A:
27.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6b4p PEPTIDYLPROLYL
ISOMERASE

(Naegleria
fowleri) 		no annotation 8 TYR A  38
ASP A  49
ARG A  54
PHE A  58
VAL A  67
TRP A  71
TYR A  94
ILE A  99
 None
 1.40A 5hw8B-6b4pA:
17.9		 5hw8B-6b4pA:
37.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6b4p PEPTIDYLPROLYL
ISOMERASE

(Naegleria
fowleri) 		no annotation 10 TYR A  38
ASP A  49
ARG A  54
PHE A  58
VAL A  67
TRP A  71
TYR A  94
ILE A  99
ILE A 103
PHE A 111
 None
 0.66A 5hw8B-6b4pA:
17.9		 5hw8B-6b4pA:
37.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6b4p PEPTIDYLPROLYL
ISOMERASE

(Naegleria
fowleri) 		no annotation 6 TYR A  38
PHE A  58
TRP A  71
ILE A  99
ILE A 103
PHE A 111
 None
 1.32A 5hw8B-6b4pA:
17.9		 5hw8B-6b4pA:
37.68
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.
6ei3 PROTON-DEPENDENT
OLIGOPEPTIDE
TRANSPORTER FAMILY
PROTEIN

(Xanthomonas
campestris) 		no annotation 5 TYR A 527
VAL A 141
ILE A  94
ILE A 132
PHE A 159
 None
 1.07A 5hw8B-6ei3A:
undetectable		 5hw8B-6ei3A:
13.69