SIMILAR PATTERNS OF AMINO ACIDS FOR 2VN1_A_FK5A501_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 PHE A 141
PHE A 153
TRP A 162
TYR A 185
ILE A 194
PHE A 202
 None
 1.18A 2vn1A-1fd9A:
17.4		 2vn1A-1fd9A:
24.07
Potential target for repurposing, i.e. matched protein structure has less than 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) 		8 TYR A 131
PHE A 141
ASP A 142
VAL A 158
TRP A 162
TYR A 185
ILE A 194
PHE A 202
 None
 0.75A 2vn1A-1fd9A:
17.4		 2vn1A-1fd9A:
24.07
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) 		10 TYR A  26
PHE A  36
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
 0.60A 2vn1A-1fkkA:
19.4		 2vn1A-1fkkA:
41.09
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.
1hxj BETA-GLUCOSIDASE

(Zea mays) 		PF00232
(Glyco_hydro_1) 		5 TYR A 163
PHE A 151
VAL A 140
TRP A  96
PHE A 166
 None
 1.36A 2vn1A-1hxjA:
undetectable		 2vn1A-1hxjA:
15.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		6 PHE A 102
PHE A 114
TRP A 123
TYR A 146
ILE A 155
PHE A 163
 None
 1.09A 2vn1A-1jvwA:
15.8		 2vn1A-1jvwA:
28.32
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.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		8 TYR A  92
PHE A 102
ARG A 108
VAL A 119
TRP A 123
TYR A 146
ILE A 155
PHE A 163
 None
 0.63A 2vn1A-1jvwA:
15.8		 2vn1A-1jvwA:
28.32
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.
1jvw MACROPHAGE
INFECTIVITY
POTENTIATOR

(Trypanosoma
cruzi) 		PF00254
(FKBP_C) 		8 TYR A  92
PHE A 102
ASP A 103
ARG A 108
TRP A 123
TYR A 146
ILE A 155
PHE A 163
 None
 0.78A 2vn1A-1jvwA:
15.8		 2vn1A-1jvwA:
28.32
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.
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
 1.47A 2vn1A-1kt1A:
17.6		 2vn1A-1kt1A:
17.75
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.
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
PHE A 130
 None
 0.75A 2vn1A-1kt1A:
17.6		 2vn1A-1kt1A:
17.75
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) 		9 TYR A  57
PHE A  67
ASP A  68
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.62A 2vn1A-1n1aA:
20.8		 2vn1A-1n1aA:
39.31
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) 		8 TYR A 135
PHE A 145
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 (-4.6A)
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
 0.36A 2vn1A-1pbkA:
18.1		 2vn1A-1pbkA:
35.82
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.
1q6h FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKPA

(Escherichia
coli) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		6 PHE A 156
PHE A 168
TRP A 177
TYR A 200
ILE A 208
PHE A 216
 None
 1.36A 2vn1A-1q6hA:
16.7		 2vn1A-1q6hA:
23.25
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.
1q6h FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKPA

(Escherichia
coli) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		9 TYR A 146
PHE A 156
ASP A 157
ARG A 162
VAL A 173
TRP A 177
TYR A 200
ILE A 208
PHE A 216
 None
 0.66A 2vn1A-1q6hA:
16.7		 2vn1A-1q6hA:
23.25
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) 		10 TYR A  40
PHE A  50
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
 0.77A 2vn1A-1r9hA:
22.0		 2vn1A-1r9hA:
44.37
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) 		8 TYR A  37
PHE A  47
ASP A  48
VAL A  66
TRP A  70
TYR A  99
ILE A 113
PHE A 121
 None
 0.64A 2vn1A-1u79A:
18.5		 2vn1A-1u79A:
41.01
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.
1wdw TRYPTOPHAN SYNTHASE
BETA CHAIN 1

(Pyrococcus
furiosus) 		PF00291
(PALP) 		5 PHE B 199
ARG B 205
TYR B  26
ILE B 195
PHE B  35
 None
 1.38A 2vn1A-1wdwB:
undetectable		 2vn1A-1wdwB:
16.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x3w PEPTIDE:N-GLYCANASE

(Saccharomyces
cerevisiae) 		PF03835
(Rad4) 		5 ASP A 242
ARG A 230
VAL A 212
TYR A 247
ILE A 246
 None
None
None
None
SUC  A1002 (-4.5A)
 1.38A 2vn1A-1x3wA:
undetectable		 2vn1A-1x3wA:
18.15
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) 		10 TYR A  26
PHE A  36
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 ( 4.8A)
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
 0.29A 2vn1A-1yatA:
20.8		 2vn1A-1yatA:
38.89
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.
2gh4 PUTATIVE GLYCOSYL
HYDROLASE YTER

(Bacillus
subtilis) 		PF07470
(Glyco_hydro_88) 		5 TYR A 285
ASP A 224
ARG A  52
TYR A 295
ILE A 226
 None
 1.23A 2vn1A-2gh4A:
undetectable		 2vn1A-2gh4A:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ozg GCN5-RELATED
N-ACETYLTRANSFERASE

(Trichormus
variabilis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		5 TYR A 214
ASP A 232
ARG A 183
PHE A 166
VAL A 158
 None
 1.49A 2vn1A-2ozgA:
undetectable		 2vn1A-2ozgA:
16.10
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) 		9 TYR A  56
PHE A  66
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
None
PEG  A 201 ( 3.9A)
PEG  A 201 (-3.6A)
PEG  A 201 (-3.7A)
None
None
None
 0.81A 2vn1A-2pbcA:
15.2		 2vn1A-2pbcA:
42.61
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.
2r4i UNCHARACTERIZED
PROTEIN

(Cytophaga
hutchinsonii) 		PF14534
(DUF4440) 		5 TYR A  53
PHE A  36
VAL A  63
TYR A 100
CYH A 118
 IPA  A 127 (-4.6A)
IPA  A 127 ( 4.1A)
None
None
IPA  A 126 ( 3.7A)
 1.34A 2vn1A-2r4iA:
undetectable		 2vn1A-2r4iA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vcd OUTER MEMBRANE
PROTEIN MIP

(Legionella
pneumophila) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		5 PHE A  65
ASP A  66
VAL A  82
TRP A  86
PHE A 126
 RAP  A 138 (-3.5A)
RAP  A 138 (-2.7A)
RAP  A 138 (-3.2A)
RAP  A 138 (-2.3A)
RAP  A 138 ( 4.7A)
 0.57A 2vn1A-2vcdA:
14.6		 2vn1A-2vcdA:
30.00
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.
2vcd OUTER MEMBRANE
PROTEIN MIP

(Legionella
pneumophila) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		5 TYR A  55
PHE A  65
ASP A  66
VAL A  82
TRP A  86
 RAP  A 138 (-2.6A)
RAP  A 138 (-3.5A)
RAP  A 138 (-2.7A)
RAP  A 138 (-3.2A)
RAP  A 138 (-2.3A)
 0.63A 2vn1A-2vcdA:
14.6		 2vn1A-2vcdA:
30.00
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
PHE A  43
ARG A  49
PHE A  53
VAL A  62
TRP A  66
TYR A  89
ILE A  98
PHE A 106
 None
 0.59A 2vn1A-2y78A:
19.2		 2vn1A-2y78A:
39.55
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
PHE A  43
ASP A  44
ARG A  49
PHE A  53
TRP A  66
TYR A  89
ILE A  98
PHE A 106
 None
 0.73A 2vn1A-2y78A:
19.2		 2vn1A-2y78A:
39.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		5 ASP A 150
ARG A 114
VAL A  64
ILE A 191
PHE A  53
 None
 1.24A 2vn1A-3b05A:
undetectable		 2vn1A-3b05A:
16.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b7x FK506-BINDING
PROTEIN 6

(Homo sapiens) 		PF00254
(FKBP_C) 		6 TYR A  61
ASP A  73
TYR A 118
CYH A 123
ILE A 127
PHE A 135
 None
 1.09A 2vn1A-3b7xA:
16.7		 2vn1A-3b7xA:
33.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b7x FK506-BINDING
PROTEIN 6

(Homo sapiens) 		PF00254
(FKBP_C) 		6 TYR A  61
PHE A  72
ASP A  73
CYH A 123
ILE A 127
PHE A 135
 None
 1.01A 2vn1A-3b7xA:
16.7		 2vn1A-3b7xA:
33.33
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.
3foc TRYPTOPHANYL-TRNA
SYNTHETASE

(Giardia
intestinalis) 		PF00579
(tRNA-synt_1b) 		6 PHE A 256
ASP A 208
ARG A 214
PHE A 212
VAL A 106
TYR A 155
 None
 1.45A 2vn1A-3focA:
undetectable		 2vn1A-3focA:
15.01
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.
3k7d GLUTAMATE-AMMONIA-LI
GASE
ADENYLYLTRANSFERASE

(Escherichia
coli) 		PF03710
(GlnE)
PF08335
(GlnD_UR_UTase) 		5 PHE A 771
VAL A 788
TYR A 688
ILE A 705
PHE A 803
 None
 1.46A 2vn1A-3k7dA:
undetectable		 2vn1A-3k7dA:
13.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o5d PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
PHE A  67
ASP A  68
PHE A  77
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.88A 2vn1A-3o5dA:
20.6		 2vn1A-3o5dA:
39.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o5d PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5

(Homo sapiens) 		PF00254
(FKBP_C) 		8 TYR A  57
PHE A  67
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.75A 2vn1A-3o5dA:
20.6		 2vn1A-3o5dA:
39.77
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  67
ASP A  68
PHE A  77
TYR A 113
ILE A 122
PHE A 130
 None
 0.83A 2vn1A-3o5eA:
21.2		 2vn1A-3o5eA:
46.53
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) 		8 TYR A  57
PHE A  67
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.85A 2vn1A-3o5eA:
21.2		 2vn1A-3o5eA:
46.53
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
PHE A  54
ARG A  60
PHE A  64
VAL A  73
TRP A  77
TYR A 100
ILE A 109
PHE A 117
 None
 0.62A 2vn1A-3pa7A:
23.8		 2vn1A-3pa7A:
80.47
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
PHE A  54
ASP A  55
ARG A  60
PHE A  64
VAL A  73
TRP A  77
ILE A 109
PHE A 117
 None
 0.75A 2vn1A-3pa7A:
23.8		 2vn1A-3pa7A:
80.47
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 PHE A 323
ASP A 324
TRP A 345
TYR A 368
ILE A 376
PHE A 384
 None
 0.82A 2vn1A-4bf8A:
17.3		 2vn1A-4bf8A:
38.89
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
PHE A 323
ASP A 324
PHE A 332
VAL A 341
TRP A 345
PHE A 384
 None
 0.94A 2vn1A-4bf8A:
17.3		 2vn1A-4bf8A:
38.89
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
PHE A 323
ASP A 324
VAL A 341
TRP A 345
TYR A 368
PHE A 384
 None
 0.86A 2vn1A-4bf8A:
17.3		 2vn1A-4bf8A:
38.89
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.
4ckm SAS-6

(Leishmania
major) 		PF16531
(SAS-6_N) 		5 TYR A 196
PHE A 209
VAL A 173
ILE A 263
PHE A 199
 None
 1.43A 2vn1A-4ckmA:
undetectable		 2vn1A-4ckmA:
21.74
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
PHE A  63
TRP A  88
ILE A 119
PHE A 127
 None
 0.54A 2vn1A-4dipA:
17.9		 2vn1A-4dipA:
33.59
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
 0.62A 2vn1A-4dipA:
17.9		 2vn1A-4dipA:
33.59
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) 		10 TYR A  33
PHE A  43
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 (-4.8A)
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)
 0.42A 2vn1A-4dz3A:
20.1		 2vn1A-4dz3A:
40.94
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) 		5 PHE A  46
VAL A  55
TYR A  82
ILE A  91
PHE A  99
 None
 0.72A 2vn1A-4iqcA:
19.3		 2vn1A-4iqcA:
39.53
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) 		7 TYR A  26
PHE A  36
ARG A  42
PHE A  46
TYR A  82
ILE A  91
PHE A  99
 None
 0.80A 2vn1A-4iqcA:
19.3		 2vn1A-4iqcA:
39.53
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) 		7 TYR A  26
PHE A  36
ASP A  37
ARG A  42
TYR A  82
ILE A  91
PHE A  99
 None
 0.73A 2vn1A-4iqcA:
19.3		 2vn1A-4iqcA:
39.53
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.
4law PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP4

(Homo sapiens) 		PF00254
(FKBP_C) 		9 TYR A  57
PHE A  67
ARG A  73
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
None
None
None
DMS  A 304 (-3.5A)
DMS  A 304 ( 4.0A)
None
None
DMS  A 304 (-4.3A)
 0.87A 2vn1A-4lawA:
21.0		 2vn1A-4lawA:
22.09
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.
4law PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP4

(Homo sapiens) 		PF00254
(FKBP_C) 		9 TYR A  57
PHE A  67
ASP A  68
ARG A  73
PHE A  77
VAL A  86
TRP A  90
ILE A 122
PHE A 130
 None
None
None
None
None
DMS  A 304 (-3.5A)
DMS  A 304 ( 4.0A)
None
DMS  A 304 (-4.3A)
 0.92A 2vn1A-4lawA:
21.0		 2vn1A-4lawA:
22.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4msp PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP14

(Homo sapiens) 		PF00254
(FKBP_C)
PF13499
(EF-hand_7) 		6 TYR A  33
PHE A  44
TRP A  69
TYR A  92
ILE A 100
PHE A 108
 None
 0.64A 2vn1A-4mspA:
18.0		 2vn1A-4mspA:
31.58
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) 		9 TYR A  56
PHE A  66
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 (-4.7A)
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)
 0.28A 2vn1A-4nnrA:
16.1		 2vn1A-4nnrA:
38.03
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.
4odr PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A CHIMERA

(Homo sapiens;
Thermus
thermophilus) 		PF00254
(FKBP_C) 		5 TYR A  13
ASP A  23
TYR A  63
ILE A  72
PHE A  80
 FK5  A 201 ( 3.6A)
FK5  A 201 (-3.6A)
FK5  A 201 (-4.4A)
None
FK5  A 201 ( 4.8A)
 0.43A 2vn1A-4odrA:
13.1		 2vn1A-4odrA:
23.36
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
PHE A  67
ARG A  73
PHE A  77
VAL A  86
TRP A  90
TYR A 113
PHE A 130
 None
 0.79A 2vn1A-4r0xA:
22.2		 2vn1A-4r0xA:
49.61
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) 		7 TYR A  57
PHE A  67
ASP A  68
ARG A  73
PHE A  77
TYR A 113
PHE A 130
 None
 0.86A 2vn1A-4r0xA:
22.2		 2vn1A-4r0xA:
49.61
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) 		7 TYR A  57
PHE A  67
ASP A  68
PHE A  77
TYR A 113
ILE A 122
PHE A 130
 None
 0.88A 2vn1A-4r0xA:
22.2		 2vn1A-4r0xA:
49.61
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
PHE A  67
PHE A  77
VAL A  86
TRP A  90
TYR A 113
ILE A 122
PHE A 130
 None
 0.76A 2vn1A-4r0xA:
22.2		 2vn1A-4r0xA:
49.61
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) 		10 TYR C  36
PHE C  55
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 ( 4.8A)
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)
 0.51A 2vn1A-5b8iC:
18.4		 2vn1A-5b8iC:
36.23
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) 		9 TYR A  26
PHE A  36
ASP A  37
ARG A  42
PHE A  46
VAL A  55
TRP A  59
TYR A  82
PHE A 146
 None
 0.65A 2vn1A-5i7pA:
17.9		 2vn1A-5i7pA:
32.39
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) 		9 TYR A  26
PHE A  36
ASP A  37
ARG A  42
PHE A  46
VAL A  55
TRP A  59
TYR A  82
PHE A 147
 None
 0.59A 2vn1A-5i7qA:
18.2		 2vn1A-5i7qA:
32.20
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
ASP A  41
ARG A  46
PHE A  50
VAL A  59
TYR A  97
ILE A 102
 None
 1.38A 2vn1A-5i98A:
17.8		 2vn1A-5i98A:
33.58
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
PHE A  40
ASP A  41
ARG A  46
PHE A  50
VAL A  59
TRP A  63
TYR A  97
ILE A 106
PHE A 114
 None
 0.66A 2vn1A-5i98A:
17.8		 2vn1A-5i98A:
33.58
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) 		10 TYR A  27
PHE A  37
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
 0.76A 2vn1A-5j6eA:
19.3		 2vn1A-5j6eA:
42.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jd3 LAE5

(uncultured
bacterium) 		PF13472
(Lipase_GDSL_2) 		5 TYR A   2
PHE A 208
VAL A 129
ILE A  11
PHE A   3
 None
 1.49A 2vn1A-5jd3A:
undetectable		 2vn1A-5jd3A:
17.43
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.
5l1b GLUTAMATE RECEPTOR
2,GLUTAMATE RECEPTOR
2

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 ASP A 138
ARG A 141
VAL A 205
TYR A 177
ILE A 168
 None
 1.35A 2vn1A-5l1bA:
undetectable		 2vn1A-5l1bA:
11.60
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.
5v8t UBIQUITIN-LIKE
PROTEIN
SMT3,PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei;
Saccharomyces
cerevisiae) 		no annotation 10 TYR A  33
PHE A  43
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 (-4.8A)
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)
 0.52A 2vn1A-5v8tA:
20.3		 2vn1A-5v8tA:
20.80
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.
5x5y PROBABLE ATP-BINDING
COMPONENT OF ABC
TRANSPORTER

(Pseudomonas
aeruginosa) 		no annotation 5 PHE B 165
ASP B 194
PHE B  46
CYH B 204
ILE B 203
 None
 1.45A 2vn1A-5x5yB:
undetectable		 2vn1A-5x5yB:
22.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5xb0 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00254
(FKBP_C) 		6 PHE A 157
PHE A 166
TRP A 175
TYR A 198
ILE A 207
PHE A 215
 None
TLA  A 301 ( 4.6A)
TLA  A 301 (-3.4A)
None
None
None
 1.23A 2vn1A-5xb0A:
16.2		 2vn1A-5xb0A:
35.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5xb0 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00254
(FKBP_C) 		8 TYR A 147
PHE A 157
ASP A 158
VAL A 171
TRP A 175
TYR A 198
ILE A 207
PHE A 215
 TLA  A 301 ( 4.4A)
None
TLA  A 301 (-3.7A)
TLA  A 301 (-3.4A)
TLA  A 301 (-3.4A)
None
None
None
 0.87A 2vn1A-5xb0A:
16.2		 2vn1A-5xb0A:
35.21
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
 1.45A 2vn1A-6b4pA:
21.3		 2vn1A-6b4pA:
43.85
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
PHE A  48
ASP A  49
ARG A  54
PHE A  58
VAL A  67
TRP A  71
TYR A  94
ILE A 103
PHE A 111
 None
 0.59A 2vn1A-6b4pA:
21.3		 2vn1A-6b4pA:
43.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ba5 INACTIVE
TYROSINE-PROTEIN
KINASE TRANSMEMBRANE
RECEPTOR ROR1
VARIABLE DOMAIN
HEAVY CHAIN,
ANTIBODY R11
VARIABLE DOMAIN OF
LIGHT CHAIN,
ANTIBODY R11

(Homo sapiens) 		no annotation 5 TYR B  96
PHE B 103
ASP B 102
ARG M 332
VAL A  96
 None
 1.40A 2vn1A-6ba5B:
undetectable		 2vn1A-6ba5B:
20.30