SIMILAR PATTERNS OF AMINO ACIDS FOR 2WKO_A_CUA154

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.
1aso ASCORBATE OXIDASE

(Cucurbita pepo) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  60
HIS A 106
HIS A 104
HIS A 450
 CU  A 557 ( 3.1A)
CU  A 555 (-3.3A)
CU  A 556 (-3.1A)
CU  A 555 ( 3.2A)
 0.87A 2wkoA-1asoA:
undetectable		 2wkoA-1asoA:
13.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1eqw CU,ZN SUPEROXIDE
DISMUTASE

(Salmonella
enterica) 		PF00080
(Sod_Cu) 		4 HIS A  44
HIS A  46
HIS A  61
HIS A 118
 CU  A 502 (-3.3A)
CU  A 502 (-3.2A)
ZN  A 501 ( 3.2A)
CU  A 502 (-3.1A)
 0.35A 2wkoA-1eqwA:
18.8		 2wkoA-1eqwA:
31.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1eso CU, ZN SUPEROXIDE
DISMUTASE

(Escherichia
coli) 		PF00080
(Sod_Cu) 		4 HIS A  44
HIS A  46
HIS A  61
HIS A 118
 CU  A 150 ( 3.2A)
CU  A 150 ( 3.3A)
ZN  A 149 ( 3.2A)
CU  A 150 ( 3.2A)
 0.22A 2wkoA-1esoA:
19.3		 2wkoA-1esoA:
32.12
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.
1gyc LACCASE 2

(Trametes
versicolor) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 400
 CU  A1502 (-3.1A)
CU  A1501 (-3.4A)
CU  A1500 (-3.3A)
CU  A1501 ( 3.2A)
 0.95A 2wkoA-1gycA:
undetectable		 2wkoA-1gycA:
14.43
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.
1hfu LACCASE 1

(Coprinopsis
cinerea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 401
 CU  A 703 (-4.7A)
CU  A 702 (-3.2A)
CU  A 703 (-3.2A)
CU  A 702 (-3.2A)
 0.97A 2wkoA-1hfuA:
undetectable		 2wkoA-1hfuA:
14.85
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.
1hfu LACCASE 1

(Coprinopsis
cinerea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 451
HIS A 401
HIS A 399
HIS A 111
 CU  A 702 (-3.2A)
CU  A 702 (-3.2A)
CU  A 702 ( 3.7A)
CU  A 702 (-3.2A)
 1.12A 2wkoA-1hfuA:
undetectable		 2wkoA-1hfuA:
14.85
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 103
HIS A 101
HIS A 161
HIS A 978
 CU  A1051 (-3.3A)
CU  A1052 (-3.2A)
CU  A1051 (-3.3A)
CU  A1052 ( 3.2A)
 1.10A 2wkoA-1kcwA:
2.1		 2wkoA-1kcwA:
9.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 978
HIS A1020
HIS A 980
HIS A1022
 CU  A1052 ( 3.2A)
CU  A1050 (-3.2A)
CU  A1050 (-3.0A)
CU  A1051 (-3.2A)
 1.11A 2wkoA-1kcwA:
2.1		 2wkoA-1kcwA:
9.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lla HEMOCYANIN (SUBUNIT
TYPE II)

(Limulus
polyphemus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 HIS A 204
HIS A 324
HIS A 364
HIS A 177
 CU  A 629 (-3.1A)
CU  A 630 (-3.3A)
CU  A 630 (-3.0A)
CU  A 629 (-3.2A)
 1.08A 2wkoA-1llaA:
2.1		 2wkoA-1llaA:
12.90
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.
1lnl HEMOCYANIN

(Rapana venosa) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS A 212
HIS A  41
HIS A  70
HIS A 185
 CU  A5012 (-3.1A)
CU  A5001 (-2.9A)
CU  A5001 ( 3.1A)
CU  A5012 (-3.2A)
 1.08A 2wkoA-1lnlA:
undetectable		 2wkoA-1lnlA:
15.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lox 15-LIPOXYGENASE

(Oryctolagus
cuniculus) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		4 HIS A 361
HIS A 541
HIS A 545
HIS A 366
 FE2  A 840 (-3.3A)
FE2  A 840 ( 3.4A)
FE2  A 840 (-3.3A)
FE2  A 840 (-3.4A)
 1.07A 2wkoA-1loxA:
2.2		 2wkoA-1loxA:
11.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1oal SUPEROXIDE DISMUTASE

(Photobacterium
leiognathi) 		PF00080
(Sod_Cu) 		4 HIS A  45
HIS A  47
HIS A  70
HIS A 125
 CU  A 153 (-3.0A)
CU  A 153 (-3.1A)
ZN  A 152 ( 3.1A)
CU  A 153 (-3.2A)
 0.18A 2wkoA-1oalA:
20.4		 2wkoA-1oalA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1p1v SUPEROXIDE DISMUTASE
[CU-ZN]

(Homo sapiens) 		PF00080
(Sod_Cu) 		4 HIS A  46
HIS A  48
HIS A  63
HIS A 120
 ZN  A 201 ( 3.1A)
ZN  A 201 ( 3.2A)
ZN  A 202 (-3.1A)
ZN  A 201 ( 3.2A)
 0.31A 2wkoA-1p1vA:
30.4		 2wkoA-1p1vA:
98.69
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.
1pss PHOTOSYNTHETIC
REACTION CENTER
PHOTOSYNTHETIC
REACTION CENTER

(Rhodobacter
sphaeroides;
Rhodobacter
sphaeroides) 		PF00124
(Photo_RC)
PF00124
(Photo_RC) 		4 HIS L 190
HIS M 219
HIS M 266
HIS L 230
 FE  M 302 ( 3.3A)
FE  M 302 ( 3.3A)
FE  M 302 (-3.3A)
FE  M 302 (-3.4A)
 1.01A 2wkoA-1pssL:
undetectable		 2wkoA-1pssL:
21.09
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.
1pss PHOTOSYNTHETIC
REACTION CENTER
PHOTOSYNTHETIC
REACTION CENTER

(Rhodobacter
sphaeroides;
Rhodobacter
sphaeroides) 		PF00124
(Photo_RC)
PF00124
(Photo_RC) 		4 HIS M 219
HIS L 190
HIS L 230
HIS M 266
 FE  M 302 ( 3.3A)
FE  M 302 ( 3.3A)
FE  M 302 (-3.4A)
FE  M 302 (-3.3A)
 0.96A 2wkoA-1pssM:
undetectable		 2wkoA-1pssM:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzs SUPEROXIDE DISMUTASE
[CU-ZN]

(Mycobacterium
tuberculosis) 		PF00080
(Sod_Cu) 		4 HIS A  47
HIS A  49
HIS A  75
HIS A 126
 CU  A 172 (-3.1A)
CU  A 172 (-3.2A)
CU  A 172 (-4.1A)
CU  A 172 (-3.2A)
 0.12A 2wkoA-1pzsA:
18.6		 2wkoA-1pzsA:
27.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1srd COPPER,ZINC
SUPEROXIDE DISMUTASE

(Spinacia
oleracea) 		PF00080
(Sod_Cu) 		4 HIS A  46
HIS A  48
HIS A  63
HIS A 120
 CU  A 155 (-3.0A)
CU  A 155 (-3.2A)
CU  A 155 ( 3.2A)
CU  A 155 (-3.0A)
 0.36A 2wkoA-1srdA:
29.2		 2wkoA-1srdA:
55.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1sxz PROTEIN (CU-ZN
SUPEROXIDE
DISMUTASE)

(Bos taurus) 		PF00080
(Sod_Cu) 		4 HIS A  44
HIS A  46
HIS A  61
HIS A 118
 CU  A 152 ( 3.1A)
CU  A 152 (-3.4A)
ZN  A 153 ( 3.1A)
CU  A 152 (-3.2A)
 0.27A 2wkoA-1sxzA:
31.3		 2wkoA-1sxzA:
81.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1to5 SUPEROXIDE DISMUTASE

(Schistosoma
mansoni) 		PF00080
(Sod_Cu) 		4 HIS A  45
HIS A  47
HIS A  62
HIS A 119
 CU  A 712 (-3.3A)
CU  A 712 (-3.4A)
ZN  A 711 ( 3.1A)
CU  A 712 (-3.2A)
 0.23A 2wkoA-1to5A:
30.6		 2wkoA-1to5A:
57.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v10 LACCASE

(Rigidoporus
microporus) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 401
 CU  A1502 (-3.2A)
CU  A1501 (-3.3A)
CU  A1500 (-3.3A)
CU  A1501 ( 3.2A)
 1.00A 2wkoA-1v10A:
undetectable		 2wkoA-1v10A:
14.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xso COPPER,ZINC
SUPEROXIDE DISMUTASE

(Xenopus laevis) 		PF00080
(Sod_Cu) 		4 HIS A  44
HIS A  46
HIS A  61
HIS A 118
 CU  A   1 ( 3.0A)
CU  A   1 ( 3.4A)
ZN  A 152 (-3.1A)
CU  A   1 ( 3.3A)
 0.33A 2wkoA-1xsoA:
30.9		 2wkoA-1xsoA:
65.58
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.
1z9n SUPEROXIDE DISMUTASE
[CU-ZN]

([Haemophilus]
ducreyi) 		PF00080
(Sod_Cu) 		4 HIS A  70
HIS A  72
HIS A  95
HIS A 151
 CU  A 200 (-3.1A)
CU  A 200 (-3.2A)
ZN  A 201 ( 3.1A)
CU  A 200 (-3.2A)
 0.17A 2wkoA-1z9nA:
19.0		 2wkoA-1z9nA:
29.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1z9p SUPEROXIDE DISMUTASE
[CU-ZN]

([Haemophilus]
ducreyi) 		PF00080
(Sod_Cu) 		4 HIS A  70
HIS A  72
HIS A  95
HIS A 151
 CU  A 200 (-3.1A)
CU  A 200 (-3.2A)
ZN  A 201 ( 3.1A)
CU  A 200 (-3.2A)
 0.17A 2wkoA-1z9pA:
19.0		 2wkoA-1z9pA:
31.43
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.
1zef ALKALINE PHOSPHATASE

(Homo sapiens) 		PF00245
(Alk_phosphatase) 		4 HIS A 432
HIS A 360
HIS A 320
HIS A 358
 ZN  A 901 ( 3.2A)
None
ZN  A 901 ( 3.3A)
ZN  A 902 (-3.2A)
 1.01A 2wkoA-1zefA:
undetectable		 2wkoA-1zefA:
15.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zpu IRON TRANSPORT
MULTICOPPER OXIDASE
FET3

(Saccharomyces
cerevisiae) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  81
HIS A 128
HIS A 126
HIS A 418
 CU1  A1004 (-3.3A)
CU1  A1002 (-3.3A)
CU1  A1003 (-3.2A)
CU1  A1002 ( 3.3A)
 0.91A 2wkoA-1zpuA:
undetectable		 2wkoA-1zpuA:
14.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2aps PROTEIN (CU,ZN
SUPEROXIDE
DISMUTASE)

(Actinobacillus
pleuropneumoniae) 		PF00080
(Sod_Cu) 		4 HIS A  60
HIS A  62
HIS A  85
HIS A 141
 CU  A 402 ( 3.3A)
CU  A 402 ( 3.4A)
ZN  A 400 (-3.2A)
CU  A 402 ( 3.1A)
 0.28A 2wkoA-2apsA:
19.0		 2wkoA-2apsA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2aqt SUPEROXIDE DISMUTASE
[CU-ZN]

(Neisseria
meningitidis) 		no annotation 4 HIS C  79
HIS C  81
HIS C 104
HIS C 160
 CU1  C 200 (-3.1A)
CU1  C 200 (-3.3A)
ZN  C 201 ( 3.1A)
CU1  C 200 (-3.2A)
 0.18A 2wkoA-2aqtC:
19.4		 2wkoA-2aqtC:
30.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2e47 TIME INTERVAL
MEASURING ENZYME
TIME

(Bombyx mori) 		PF00080
(Sod_Cu) 		4 HIS A  50
HIS A  52
HIS A  67
HIS A 124
 CU  A 171 (-3.1A)
CU  A 171 (-3.2A)
ZN  A 172 ( 3.1A)
CU  A 171 (-3.2A)
 0.25A 2wkoA-2e47A:
28.2		 2wkoA-2e47A:
51.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fqd BLUE COPPER OXIDASE
CUEO

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 101
HIS A 143
HIS A 141
HIS A 448
 C2O  A 602 (-3.9A)
C2O  A 602 (-3.5A)
C2O  A 602 (-3.2A)
C2O  A 602 (-3.3A)
 1.03A 2wkoA-2fqdA:
undetectable		 2wkoA-2fqdA:
15.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hzh LACCASE

(Trametes
ochracea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 400
 CU  A 604 ( 3.1A)
CU  A 602 (-3.2A)
CU  A 603 (-3.4A)
CU  A 602 ( 3.2A)
 0.96A 2wkoA-2hzhA:
undetectable		 2wkoA-2hzhA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hzh LACCASE

(Trametes
ochracea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 398
HIS A 452
HIS A 400
HIS A 454
 CU  A 604 (-3.1A)
CU  A 602 (-3.1A)
CU  A 602 ( 3.2A)
CU  A 603 (-3.3A)
 1.10A 2wkoA-2hzhA:
undetectable		 2wkoA-2hzhA:
15.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2jlp EXTRACELLULAR
SUPEROXIDE DISMUTASE
(CU-ZN)

(Homo sapiens) 		PF00080
(Sod_Cu) 		4 HIS A  96
HIS A  98
HIS A 113
HIS A 163
 CU  A 225 (-3.2A)
CU  A 225 (-3.2A)
ZN  A 226 ( 3.1A)
CU  A 225 (-3.2A)
 0.19A 2wkoA-2jlpA:
24.3		 2wkoA-2jlpA:
30.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2k4w SUPEROXIDE DISMUTASE
[CU-ZN]

(Salmonella
enterica) 		PF00080
(Sod_Cu) 		4 HIS A  48
HIS A  50
HIS A  73
HIS A 128
 CU1  A 155 (-3.1A)
CU1  A 155 (-3.3A)
ZN  A 156 ( 3.2A)
CU1  A 155 (-3.0A)
 0.72A 2wkoA-2k4wA:
14.9		 2wkoA-2k4wA:
31.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q2l SUPEROXIDE DISMUTASE

(Potentilla
atrosanguinea) 		PF00080
(Sod_Cu) 		4 HIS A  45
HIS A  47
HIS A  62
HIS A 119
 None
None
ZN  A1001 (-3.1A)
None
 0.28A 2wkoA-2q2lA:
29.7		 2wkoA-2q2lA:
55.84
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.
2qt6 LACCASE

(Lentinus
tigrinus) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 399
 CU  A 500 (-3.1A)
CU  A 501 ( 3.2A)
CU  A 502 (-3.2A)
CU  A 501 ( 3.2A)
 0.93A 2wkoA-2qt6A:
2.1		 2wkoA-2qt6A:
15.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wwo SUPEROXIDE DISMUTASE
[CU-ZN]

(Yersinia
pseudotuberculosis) 		PF00080
(Sod_Cu) 		4 HIS A  54
HIS A  56
HIS A  79
HIS A 135
 ZN  A1165 (-3.3A)
ZN  A1165 (-3.4A)
ZN  A1162 ( 3.2A)
ZN  A1165 (-3.3A)
 0.27A 2wkoA-2wwoA:
19.3		 2wkoA-2wwoA:
31.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xyb LACCASE

(Trametes
cinnabarina) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 400
 CU  A 504 ( 3.1A)
CU  A 502 (-3.2A)
CU  A 503 ( 3.2A)
CU  A 502 (-3.2A)
 0.96A 2wkoA-2xybA:
undetectable		 2wkoA-2xybA:
16.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3abg BILIRUBIN OXIDASE

(Albifimbria
verrucaria) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  94
HIS A 136
HIS A 134
HIS A 403
 CU  A 703 (-3.0A)
CU  A 701 (-3.2A)
CU  A 702 (-3.1A)
CU  A 701 ( 3.1A)
 0.95A 2wkoA-3abgA:
undetectable		 2wkoA-3abgA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3abg BILIRUBIN OXIDASE

(Albifimbria
verrucaria) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 401
HIS A 456
HIS A 403
HIS A 458
 CU  A 703 (-3.4A)
CU  A 701 (-3.3A)
CU  A 701 ( 3.1A)
CU  A 702 (-3.5A)
 1.12A 2wkoA-3abgA:
undetectable		 2wkoA-3abgA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aw5 MULTICOPPER OXIDASE

(Pyrobaculum
aerophilum) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  92
HIS A 134
HIS A 132
HIS A 396
 CU  A 703 ( 3.0A)
C2O  A 702 (-3.3A)
C2O  A 702 (-3.3A)
C2O  A 702 ( 3.3A)
 1.07A 2wkoA-3aw5A:
undetectable		 2wkoA-3aw5A:
17.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ce1 SUPEROXIDE DISMUTASE
[CU-ZN]

(Naganishia
liquefaciens) 		PF00080
(Sod_Cu) 		4 HIS A  50
HIS A  52
HIS A  67
HIS A 124
 CU  A 201 (-3.6A)
CU  A 201 (-3.2A)
ZN  A 202 ( 3.1A)
CU  A 201 (-3.1A)
 0.23A 2wkoA-3ce1A:
30.1		 2wkoA-3ce1A:
60.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eyy PUTATIVE IRON UPTAKE
REGULATORY PROTEIN

(Streptomyces
coelicolor) 		PF01475
(FUR) 		4 HIS A  86
HIS A  90
HIS A  88
HIS A  33
 ZN  A 147 (-3.3A)
ZN  A 147 (-3.3A)
ZN  A 147 (-3.7A)
ZN  A 147 (-3.3A)
 1.00A 2wkoA-3eyyA:
undetectable		 2wkoA-3eyyA:
19.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f7l COPPER,ZINC
SUPEROXIDE DISMUTASE

(Alvinella
pompejana) 		PF00080
(Sod_Cu) 		4 HIS A  44
HIS A  46
HIS A  61
HIS A 118
 CU  A 202 ( 2.9A)
CU1  A 201 ( 3.1A)
ZN  A 203 (-3.1A)
CU1  A 201 ( 3.2A)
 0.17A 2wkoA-3f7lA:
30.5		 2wkoA-3f7lA:
61.44
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.
3fcm HYDROLASE, NUDIX
FAMILY

(Clostridium
perfringens) 		PF00293
(NUDIX) 		4 HIS A  43
HIS A 129
HIS A  75
HIS A 127
 MN  A 201 (-3.4A)
MN  A 201 (-3.5A)
MN  A 201 (-3.3A)
MN  A 201 (-3.6A)
 1.05A 2wkoA-3fcmA:
undetectable		 2wkoA-3fcmA:
22.58
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.
3fcm HYDROLASE, NUDIX
FAMILY

(Clostridium
perfringens) 		PF00293
(NUDIX) 		4 HIS A 129
HIS A  43
HIS A 127
HIS A  75
 MN  A 201 (-3.5A)
MN  A 201 (-3.4A)
MN  A 201 (-3.6A)
MN  A 201 (-3.3A)
 1.00A 2wkoA-3fcmA:
undetectable		 2wkoA-3fcmA:
22.58
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.
3fsn RETINAL PIGMENT
EPITHELIUM-SPECIFIC
65 KDA PROTEIN

(Bos taurus) 		PF03055
(RPE65) 		4 HIS A 313
HIS A 180
HIS A 241
HIS A 527
 FE2  A 534 (-3.4A)
FE2  A 534 (-3.4A)
FE2  A 534 (-3.3A)
FE2  A 534 (-3.3A)
 1.12A 2wkoA-3fsnA:
undetectable		 2wkoA-3fsnA:
14.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gtt SUPEROXIDE DISMUTASE
[CU-ZN]

(Mus musculus) 		PF00080
(Sod_Cu) 		4 HIS A  46
HIS A  48
HIS A  63
HIS A 120
 None
None
ZN  A 155 (-3.2A)
None
 0.38A 2wkoA-3gttA:
31.9		 2wkoA-3gttA:
83.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kbe SUPEROXIDE DISMUTASE
[CU-ZN]

(Caenorhabditis
elegans) 		PF00080
(Sod_Cu) 		4 HIS A  45
HIS A  47
HIS A  62
HIS A 119
 None
 0.68A 2wkoA-3kbeA:
20.0		 2wkoA-3kbeA:
55.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3km2 SUPEROXIDE DISMUTASE
[CU-ZN],
CHLOROPLASTIC

(Solanum
lycopersicum) 		PF00080
(Sod_Cu) 		4 HIS A  46
HIS A  48
HIS A  63
HIS A 120
 None
None
ZN  A 155 (-3.2A)
None
 0.31A 2wkoA-3km2A:
30.1		 2wkoA-3km2A:
54.55
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.
3kw7 LACCASE B

(Trametes sp.
AH28-2) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 405
 CU  A 602 (-3.1A)
CU  A 603 (-3.2A)
CU  A 604 (-3.2A)
CU  A 603 ( 3.0A)
 0.88A 2wkoA-3kw7A:
undetectable		 2wkoA-3kw7A:
16.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kw7 LACCASE B

(Trametes sp.
AH28-2) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 403
HIS A 455
HIS A 405
HIS A 457
 CU  A 602 (-3.0A)
CU  A 603 (-3.1A)
CU  A 603 ( 3.0A)
CU  A 604 (-3.1A)
 1.10A 2wkoA-3kw7A:
undetectable		 2wkoA-3kw7A:
16.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l9y SUPEROXIDE DISMUTASE
[CU-ZN]

(Bombyx mori) 		PF00080
(Sod_Cu) 		4 HIS A  45
HIS A  47
HIS A  62
HIS A 120
 CU  A 156 (-3.2A)
CU  A 156 (-3.2A)
ZN  A 155 ( 3.1A)
CU  A 156 (-3.1A)
 0.15A 2wkoA-3l9yA:
29.9		 2wkoA-3l9yA:
63.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mnd SUPEROXIDE DISMUTASE
[CU-ZN]

(Taenia solium) 		PF00080
(Sod_Cu) 		4 HIS A  43
HIS A  45
HIS A  60
HIS A 117
 CU  A 155 (-3.1A)
CU  A 155 (-3.5A)
ZN  A 153 ( 3.1A)
CU  A 155 (-3.4A)
 0.27A 2wkoA-3mndA:
29.8		 2wkoA-3mndA:
56.49
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.
3pps LACCASE

(Thielavia
arenaria) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  94
HIS A 141
HIS A 139
HIS A 437
 CU  A 604 ( 3.1A)
CU  A 602 ( 3.3A)
CU  A 603 ( 3.1A)
CU  A 602 (-3.3A)
 1.01A 2wkoA-3ppsA:
undetectable		 2wkoA-3ppsA:
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.
3pxl LACCASE

(Trametes
hirsuta) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 400
 CU  A1502 ( 3.0A)
CU  A1500 (-3.2A)
CU  A1501 (-3.2A)
CU  A1500 ( 3.2A)
 0.96A 2wkoA-3pxlA:
undetectable		 2wkoA-3pxlA:
15.84
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.
3t6w LACCASE

(Steccherinum
ochraceum) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  65
HIS A 112
HIS A 110
HIS A 402
 CU  A 504 (-3.1A)
CU  A 503 (-3.4A)
CU  A 502 ( 3.5A)
CU  A 503 ( 3.2A)
 0.92A 2wkoA-3t6wA:
undetectable		 2wkoA-3t6wA:
14.68
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.
3v9e LACCASE

(Botrytis aclada) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  87
HIS A 133
HIS A 131
HIS A 431
 CU  A 602 ( 4.7A)
CU  A 602 (-3.3A)
CU  A 603 (-3.2A)
CU  A 602 (-3.1A)
 1.04A 2wkoA-3v9eA:
undetectable		 2wkoA-3v9eA:
13.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v9e LACCASE

(Botrytis aclada) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  89
HIS A  87
HIS A 131
HIS A 429
 CU  A 603 (-2.9A)
CU  A 602 ( 4.7A)
CU  A 603 (-3.2A)
CU  A 602 (-3.6A)
 1.09A 2wkoA-3v9eA:
undetectable		 2wkoA-3v9eA:
13.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w6q TYROSINASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		4 HIS A 103
HIS A 328
HIS A 372
HIS A  94
 None
 1.05A 2wkoA-3w6qA:
undetectable		 2wkoA-3w6qA:
14.12
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.
3x1b LACCASE

(Lentinus) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  85
HIS A 132
HIS A 130
HIS A 422
 CU  A 614 (-3.1A)
CU  A 616 (-3.2A)
CU  A 615 (-3.2A)
CU  A 616 ( 3.2A)
 0.93A 2wkoA-3x1bA:
undetectable		 2wkoA-3x1bA:
15.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zx1 OXIDOREDUCTASE,
PUTATIVE

(Campylobacter
jejuni) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 141
HIS A 139
HIS A 180
HIS A 442
 CU  A 602 (-3.0A)
CU  A 604 ( 3.0A)
CU  A 602 ( 3.1A)
CU  A 604 ( 3.0A)
 1.12A 2wkoA-3zx1A:
undetectable		 2wkoA-3zx1A:
14.64
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS B2974
HIS B3075
HIS B3106
HIS B2965
 CUO  B9008 (-2.9A)
CUO  B9008 (-2.8A)
CUO  B9008 (-3.3A)
CUO  B9008 (-3.2A)
 0.83A 2wkoA-4bedB:
undetectable		 2wkoA-4bedB:
6.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS B3075
HIS B3106
HIS B2974
HIS B3079
 CUO  B9008 (-2.8A)
CUO  B9008 (-3.3A)
CUO  B9008 (-2.9A)
CUO  B9008 (-3.5A)
 1.01A 2wkoA-4bedB:
undetectable		 2wkoA-4bedB:
6.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i7h PEROXIDE STRESS
SENSING REGULATOR

(Streptococcus
pyogenes) 		PF01475
(FUR) 		4 HIS A   6
HIS A   4
HIS A  99
HIS A  19
 NI  A 201 (-3.6A)
NI  A 201 (-3.6A)
NI  A 201 (-3.5A)
NI  A 201 (-3.5A)
 1.09A 2wkoA-4i7hA:
undetectable		 2wkoA-4i7hA:
19.77
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.
4j3q CATECHOL OXIDASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		4 HIS A 119
HIS A 284
HIS A 312
HIS A 110
 CU  A1001 (-3.2A)
CU  A1002 (-3.2A)
CU  A1002 (-3.2A)
CU  A1001 (-3.3A)
 1.11A 2wkoA-4j3qA:
undetectable		 2wkoA-4j3qA:
19.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jhv LACCASE

(Coriolopsis
caperata) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 399
 CU  A 504 ( 2.8A)
CU  A 501 (-3.2A)
CU  A 502 (-3.2A)
CU  A 501 ( 3.2A)
 0.96A 2wkoA-4jhvA:
undetectable		 2wkoA-4jhvA:
15.74
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.
4jhv LACCASE

(Coriolopsis
caperata) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 397
HIS A 449
HIS A 399
HIS A 451
 CU  A 504 (-2.7A)
CU  A 501 (-3.1A)
CU  A 501 ( 3.2A)
CU  A 502 (-3.3A)
 1.11A 2wkoA-4jhvA:
undetectable		 2wkoA-4jhvA:
15.74
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.
4l05 SUPEROXIDE DISMUTASE
[CU-ZN]

(Brucella
abortus) 		PF00080
(Sod_Cu) 		4 HIS A  48
HIS A  50
HIS A  73
HIS A 128
 CU1  A 201 ( 3.1A)
CU1  A 201 ( 3.2A)
ZN  A 203 (-3.1A)
CU1  A 201 ( 3.2A)
 0.27A 2wkoA-4l05A:
19.9		 2wkoA-4l05A:
29.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4oja SUPEROXIDE DISMUTASE
[CU-ZN]

(Hydra vulgaris) 		PF00080
(Sod_Cu) 		4 HIS A  45
HIS A  47
HIS A  62
HIS A 119
 CU  A 201 (-3.4A)
CU  A 201 (-3.3A)
ZN  A 202 ( 3.2A)
CU  A 201 (-3.2A)
 0.23A 2wkoA-4ojaA:
28.4		 2wkoA-4ojaA:
49.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4rvp SUPEROXIDE DISMUTASE

(Sedum alfredii) 		PF00080
(Sod_Cu) 		4 HIS A  58
HIS A  60
HIS A  75
HIS A 132
 None
None
ZN  A 201 (-3.2A)
None
 0.29A 2wkoA-4rvpA:
29.4		 2wkoA-4rvpA:
56.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u4i CU/ZN SUPEROXIDE
DISMUTASE

(Megavirus
chiliensis) 		PF00080
(Sod_Cu) 		4 HIS A  54
HIS A  56
HIS A  71
HIS A 128
 None
 0.53A 2wkoA-4u4iA:
19.6		 2wkoA-4u4iA:
36.36
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.
4w1t COPPER OXIDASE

(Streptomyces
sviceus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 153
HIS A 151
HIS A 101
HIS A 223
 CU  A 404 (-3.0A)
None
CU  A 404 (-3.1A)
None
 1.08A 2wkoA-4w1tA:
undetectable		 2wkoA-4w1tA:
18.77
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.
4ymk ACYL-COA DESATURASE
1

(Mus musculus) 		PF00487
(FA_desaturase) 		4 HIS A 116
HIS A 121
HIS A 153
HIS A 297
 ZN  A 401 ( 3.5A)
ZN  A 401 (-3.4A)
ZN  A 401 ( 3.2A)
ZN  A 401 (-3.2A)
 0.93A 2wkoA-4ymkA:
undetectable		 2wkoA-4ymkA:
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.
4ymk ACYL-COA DESATURASE
1

(Mus musculus) 		PF00487
(FA_desaturase) 		4 HIS A 157
HIS A 156
HIS A 153
HIS A 298
 ZN  A 401 (-3.3A)
ZN  A 402 (-3.4A)
ZN  A 401 ( 3.2A)
ZN  A 402 (-3.4A)
 0.82A 2wkoA-4ymkA:
undetectable		 2wkoA-4ymkA:
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.
4ymk ACYL-COA DESATURASE
1

(Mus musculus) 		PF00487
(FA_desaturase) 		4 HIS A 298
HIS A 297
HIS A 294
HIS A 157
 ZN  A 402 (-3.4A)
ZN  A 401 (-3.2A)
ZN  A 402 (-3.1A)
ZN  A 401 (-3.3A)
 0.80A 2wkoA-4ymkA:
undetectable		 2wkoA-4ymkA:
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 244
HIS A 249
HIS A 268
HIS A 348
 ZN  A 402 (-3.7A)
ZN  A 402 (-3.2A)
ZN  A 402 (-3.5A)
ZN  A 402 (-3.3A)
 0.77A 2wkoA-4zr0A:
undetectable		 2wkoA-4zr0A:
17.56
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 272
HIS A 271
HIS A 268
HIS A 349
 ZN  A 402 (-3.4A)
ZN  A 401 (-3.2A)
ZN  A 402 (-3.5A)
ZN  A 401 (-3.2A)
 0.91A 2wkoA-4zr0A:
undetectable		 2wkoA-4zr0A:
17.56
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 326
HIS A 330
HIS A 345
HIS A 271
 ZN  A 401 (-3.4A)
ZN  A 401 (-3.3A)
ZN  A 401 (-3.5A)
ZN  A 401 (-3.2A)
 0.79A 2wkoA-4zr0A:
undetectable		 2wkoA-4zr0A:
17.56
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 330
HIS A 326
HIS A 271
HIS A 345
 ZN  A 401 (-3.3A)
ZN  A 401 (-3.4A)
ZN  A 401 (-3.2A)
ZN  A 401 (-3.5A)
 1.04A 2wkoA-4zr0A:
undetectable		 2wkoA-4zr0A:
17.56
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 345
HIS A 330
HIS A 349
HIS A 326
 ZN  A 401 (-3.5A)
ZN  A 401 (-3.3A)
ZN  A 401 (-3.2A)
ZN  A 401 (-3.4A)
 0.94A 2wkoA-4zr0A:
undetectable		 2wkoA-4zr0A:
17.56
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.
4zr0 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 349
HIS A 348
HIS A 345
HIS A 272
 ZN  A 401 (-3.2A)
ZN  A 402 (-3.3A)
ZN  A 401 (-3.5A)
ZN  A 402 (-3.4A)
 0.80A 2wkoA-4zr0A:
undetectable		 2wkoA-4zr0A:
17.56
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.
4zr1 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 244
HIS A 249
HIS A 268
HIS A 348
 ZN  A 402 (-3.5A)
ZN  A 402 (-3.2A)
ZN  A 402 (-3.3A)
ZN  A 402 (-3.3A)
 0.82A 2wkoA-4zr1A:
undetectable		 2wkoA-4zr1A:
18.65
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.
4zr1 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 272
HIS A 271
HIS A 268
HIS A 349
 ZN  A 402 (-3.5A)
ZN  A 401 ( 3.4A)
ZN  A 402 (-3.3A)
ZN  A 401 (-3.2A)
 0.85A 2wkoA-4zr1A:
undetectable		 2wkoA-4zr1A:
18.65
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.
4zr1 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 326
HIS A 330
HIS A 345
HIS A 271
 ZN  A 401 (-3.5A)
ZN  A 401 (-3.3A)
ZN  A 401 (-3.4A)
ZN  A 401 ( 3.4A)
 0.83A 2wkoA-4zr1A:
undetectable		 2wkoA-4zr1A:
18.65
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.
4zr1 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 345
HIS A 330
HIS A 349
HIS A 326
 ZN  A 401 (-3.4A)
ZN  A 401 (-3.3A)
ZN  A 401 (-3.2A)
ZN  A 401 (-3.5A)
 0.98A 2wkoA-4zr1A:
undetectable		 2wkoA-4zr1A:
18.65
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.
4zr1 CERAMIDE VERY LONG
CHAIN FATTY ACID
HYDROXYLASE SCS7

(Saccharomyces
cerevisiae) 		PF04116
(FA_hydroxylase) 		4 HIS A 349
HIS A 348
HIS A 345
HIS A 272
 ZN  A 401 (-3.2A)
ZN  A 402 (-3.3A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
 0.99A 2wkoA-4zr1A:
undetectable		 2wkoA-4zr1A:
18.65
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.
4zyo ACYL-COA DESATURASE

(Homo sapiens) 		no annotation 4 HIS A 120
HIS A 125
HIS A 157
HIS A 301
 ZN  A 401 ( 3.3A)
ZN  A 401 (-3.2A)
ZN  A 401 ( 3.2A)
ZN  A 401 (-3.4A)
 0.93A 2wkoA-4zyoA:
undetectable		 2wkoA-4zyoA:
18.57
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.
4zyo ACYL-COA DESATURASE

(Homo sapiens) 		no annotation 4 HIS A 161
HIS A 160
HIS A 157
HIS A 302
 ZN  A 401 (-3.3A)
ZN  A 402 (-3.2A)
ZN  A 401 ( 3.2A)
ZN  A 402 (-3.5A)
 0.83A 2wkoA-4zyoA:
undetectable		 2wkoA-4zyoA:
18.57
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.
4zyo ACYL-COA DESATURASE

(Homo sapiens) 		no annotation 4 HIS A 302
HIS A 301
HIS A 298
HIS A 161
 ZN  A 402 (-3.5A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.3A)
ZN  A 401 (-3.3A)
 0.91A 2wkoA-4zyoA:
undetectable		 2wkoA-4zyoA:
18.57
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.
5ehf LACCASE

(Antrodiella
faginea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  64
HIS A 111
HIS A 109
HIS A 400
 CU  A 509 (-3.2A)
CU  A 507 ( 3.3A)
CU  A 508 (-3.3A)
CU  A 507 ( 3.1A)
 0.91A 2wkoA-5ehfA:
undetectable		 2wkoA-5ehfA:
15.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5in2 EXTRACELLULAR
SUPEROXIDE DISMUTASE
[CU-ZN]

(Onchocerca
volvulus) 		PF00080
(Sod_Cu) 		4 HIS A  46
HIS A  48
HIS A  63
HIS A 120
 CU  A 203 ( 3.1A)
CU  A 203 ( 3.2A)
ZN  A 202 (-3.1A)
CU  A 203 ( 3.1A)
 0.16A 2wkoA-5in2A:
30.8		 2wkoA-5in2A:
57.69
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.
5kbm CELL SURFACE CU-ONLY
SUPEROXIDE DISMUTASE
5

(Candida
albicans) 		PF00080
(Sod_Cu) 		4 HIS A  75
HIS A  77
HIS A  93
HIS A 153
 CU1  A 201 (-3.0A)
CU1  A 201 (-3.1A)
CU1  A 201 (-4.2A)
CU1  A 201 (-3.2A)
 0.18A 2wkoA-5kbmA:
16.2		 2wkoA-5kbmA:
27.53
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.
5lm8 'MULTICOPPER OXIDASE

(Aspergillus
niger) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A 108
HIS A 154
HIS A 152
HIS A 453
 CU  A 603 ( 3.1A)
CU  A 602 ( 3.4A)
CU  A 601 ( 3.2A)
CU  A 602 (-3.1A)
 1.04A 2wkoA-5lm8A:
undetectable		 2wkoA-5lm8A:
16.60
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.
5mew LACCASE 2

(Steccherinum
murashkinskyi) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 HIS A  65
HIS A 112
HIS A 110
HIS A 402
 CU  A 503 (-3.1A)
CU  A 501 (-3.1A)
CU  A 502 (-3.1A)
CU  A 501 (-3.2A)
 0.96A 2wkoA-5mewA:
undetectable		 2wkoA-5mewA:
14.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mkm TWO-DOMAIN LACCASE

(Streptomyces
griseoflavus) 		no annotation 4 HIS A 157
HIS A 155
HIS A 105
HIS A 227
 CU  A 402 ( 3.2A)
None
CU  A 402 (-3.2A)
None
 1.12A 2wkoA-5mkmA:
undetectable		 2wkoA-5mkmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n4l CERULOPLASMIN

(Rattus
norvegicus) 		no annotation 4 HIS A 972
HIS A1016
HIS A1014
HIS A 103
 CU  A1105 (-3.3A)
CU  A1104 (-3.1A)
CU  A1101 (-3.2A)
CU  A1104 ( 3.5A)
 1.11A 2wkoA-5n4lA:
undetectable		 2wkoA-5n4lA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u8z CAROTENOID OXYGENASE
1

(Neurospora
crassa) 		PF03055
(RPE65) 		4 HIS A 313
HIS A 197
HIS A 248
HIS A 510
 FE2  A 601 ( 3.4A)
FE2  A 601 (-3.3A)
FE2  A 601 ( 3.4A)
FE2  A 601 (-3.3A)
 1.11A 2wkoA-5u8zA:
undetectable		 2wkoA-5u8zA:
15.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yq7 PRECURSOR FOR L
SUBUNITS OF
PHOTOSYNTHETIC
REACTION CENTER
PRECURSOR FOR M
SUBUNITS OF
PHOTOSYNTHETIC
REACTION CENTER

(Roseiflexus
castenholzii;
Roseiflexus
castenholzii) 		no annotation
no annotation 		4 HIS M 542
HIS L 229
HIS L 264
HIS M 589
 FE  L1005 ( 3.0A)
FE  L1005 (-3.1A)
FE  L1005 (-4.4A)
FE  L1005 (-3.2A)
 1.06A 2wkoA-5yq7M:
undetectable		 2wkoA-5yq7M:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6evg MULTI-COPPER OXIDASE
CUEO

(Ochrobactrum) 		no annotation 4 HIS A  93
HIS A  91
HIS A 131
HIS A 437
 None
EDO  A 602 ( 4.5A)
None
None
 1.08A 2wkoA-6evgA:
undetectable		 2wkoA-6evgA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6evg MULTI-COPPER OXIDASE
CUEO

(Ochrobactrum) 		no annotation 4 HIS A 437
HIS A 491
HIS A 489
HIS A  93
 None
 1.08A 2wkoA-6evgA:
undetectable		 2wkoA-6evgA:
undetectable