SIMILAR PATTERNS OF AMINO ACIDS FOR 1ZZU_B_ACTB861

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.
1dcq PYK2-ASSOCIATED
PROTEIN BETA

(Mus musculus) 		PF01412
(ArfGap)
PF12796
(Ank_2) 		4 GLY A 389
GLN A 392
VAL A 398
SER A 377
 None
 1.28A 1zzuB-1dcqA:
0.0		 1zzuB-1dcqA:
21.44
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.
1eyy ALDEHYDE
DEHYDROGENASE

(Vibrio harveyi) 		PF00171
(Aldedh) 		4 GLY A 466
GLN A  97
VAL A 442
SER A 464
 None
 1.08A 1zzuB-1eyyA:
0.0		 1zzuB-1eyyA:
20.65
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		4 GLY B 283
GLN B 250
TRP B 269
SER B 271
 None
 1.47A 1zzuB-1jtdB:
0.0		 1zzuB-1jtdB:
20.94
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.
1jvb NAD(H)-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Sulfolobus
solfataricus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 265
GLN A 290
VAL A 268
SER A 167
 None
 1.12A 1zzuB-1jvbA:
0.0		 1zzuB-1jvbA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l1f GLUTAMATE
DEHYDROGENASE 1

(Homo sapiens) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 GLY A 255
GLN A 254
VAL A 252
SER A 283
 None
 1.35A 1zzuB-1l1fA:
0.0		 1zzuB-1l1fA:
20.26
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.
1llu ALCOHOL
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 251
GLN A 252
VAL A 242
SER A 246
 None
None
None
NAD  A1250 (-3.3A)
 1.23A 1zzuB-1lluA:
0.0		 1zzuB-1lluA:
22.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lzx NITRIC-OXIDE
SYNTHASE

(Rattus
norvegicus) 		PF02898
(NO_synthase) 		5 GLY A 417
GLN A 420
TRP A 587
VAL A 649
SER A 657
 ACT  A 860 ( 3.9A)
None
HEM  A 750 (-3.4A)
ACT  A 860 (-4.3A)
ACT  A 860 ( 3.9A)
 0.17A 1zzuB-1lzxA:
62.2		 1zzuB-1lzxA:
99.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1m9q ENDOTHELIAL
NITRIC-OXIDE
SYNTHASE

(Homo sapiens) 		PF02898
(NO_synthase) 		4 GLN A 189
TRP A 356
VAL A 418
SER A 426
 None
HEM  A 901 (-3.6A)
MPD  A 604 (-4.2A)
MPD  A 604 (-3.1A)
 0.82A 1zzuB-1m9qA:
58.7		 1zzuB-1m9qA:
65.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1m9q ENDOTHELIAL
NITRIC-OXIDE
SYNTHASE

(Homo sapiens) 		PF02898
(NO_synthase) 		4 GLY A 186
GLN A 189
TRP A 356
VAL A 418
 MPD  A 604 (-3.8A)
None
HEM  A 901 (-3.6A)
MPD  A 604 (-4.2A)
 0.18A 1zzuB-1m9qA:
58.7		 1zzuB-1m9qA:
65.49
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.
1pem RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 2
ALPHA CHAIN

(Salmonella
enterica) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF08343
(RNR_N) 		4 GLY A 660
GLN A 659
VAL A 372
SER A 385
 None
 1.49A 1zzuB-1pemA:
0.0		 1zzuB-1pemA:
20.46
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.
1q8y SR PROTEIN KINASE

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase) 		4 GLY A 584
TRP A 581
VAL A 575
SER A 589
 None
 1.00A 1zzuB-1q8yA:
1.1		 1zzuB-1q8yA:
21.54
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.
1r6v SUBTILISIN-LIKE
SERINE PROTEASE

(Fervidobacterium
pennivorans) 		PF00082
(Peptidase_S8) 		4 GLY A  24
GLN A 612
VAL A 471
SER A 610
 None
 1.47A 1zzuB-1r6vA:
undetectable		 1zzuB-1r6vA:
19.57
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.
2a9v GMP SYNTHASE

(Thermoplasma
acidophilum) 		PF00117
(GATase) 		4 GLY A 153
GLN A 165
VAL A 125
SER A 146
 None
 1.02A 1zzuB-2a9vA:
undetectable		 1zzuB-2a9vA:
19.17
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.
2d5w PEPTIDE ABC
TRANSPORTER,
PEPTIDE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF00496
(SBP_bac_5) 		4 GLY A 280
GLN A 279
VAL A 262
SER A 274
 None
 1.39A 1zzuB-2d5wA:
undetectable		 1zzuB-2d5wA:
19.40
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.
2drh 361AA LONG
HYPOTHETICAL
D-AMINOPEPTIDASE

(Pyrococcus
horikoshii) 		PF03576
(Peptidase_S58) 		4 GLY A 252
GLN A 254
VAL A 258
SER A 285
 None
 1.32A 1zzuB-2drhA:
undetectable		 1zzuB-2drhA:
21.85
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.
2eer NAD-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 265
GLN A 290
VAL A 268
SER A 167
 None
 1.14A 1zzuB-2eerA:
undetectable		 1zzuB-2eerA:
22.00
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.
2jb1 L-AMINO ACID OXIDASE

(Rhodococcus
opacus) 		PF01593
(Amino_oxidase) 		4 GLY A 124
GLN A 125
VAL A 114
SER A 214
 None
 1.15A 1zzuB-2jb1A:
undetectable		 1zzuB-2jb1A:
21.39
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.
2ose PROBABLE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Mimivirus) 		PF00160
(Pro_isomerase) 		4 GLY A 127
GLN A 172
VAL A 169
SER A 125
 None
 1.17A 1zzuB-2oseA:
undetectable		 1zzuB-2oseA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z8z LIPASE

(Pseudomonas sp.
MIS38) 		PF00353
(HemolysinCabind) 		4 GLY A 226
TRP A 224
VAL A 188
SER A 231
 None
 1.37A 1zzuB-2z8zA:
undetectable		 1zzuB-2z8zA:
22.93
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.
3a24 ALPHA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		4 GLY A 496
GLN A 493
VAL A 466
SER A 538
 None
 1.22A 1zzuB-3a24A:
undetectable		 1zzuB-3a24A:
20.52
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.
3adk ADENYLATE KINASE

(Sus scrofa) 		PF00406
(ADK) 		4 GLY A  22
GLN A  24
VAL A  13
SER A  19
 SO4  A 195 (-3.6A)
None
None
SO4  A 195 (-3.6A)
 1.17A 1zzuB-3adkA:
undetectable		 1zzuB-3adkA:
20.28
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.
3d0q PROTEIN CALG3

(Micromonospora
echinospora) 		PF06722
(DUF1205) 		4 GLY A  86
GLN A  88
TRP A  85
VAL A  74
 None
 1.21A 1zzuB-3d0qA:
undetectable		 1zzuB-3d0qA:
22.18
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.
3e2d ALKALINE PHOSPHATASE

(Vibrio sp.
G15-21) 		PF00245
(Alk_phosphatase) 		4 GLY A  89
GLN A  88
VAL A  92
SER A  78
 None
 1.40A 1zzuB-3e2dA:
undetectable		 1zzuB-3e2dA:
22.52
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.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY A 279
GLN A 455
VAL A 527
SER A 218
 None
 1.40A 1zzuB-3fahA:
undetectable		 1zzuB-3fahA:
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.
3gyc PUTATIVE GLYCOSIDE
HYDROLASE

(Parabacteroides
distasonis) 		PF12876
(Cellulase-like) 		4 GLY A 364
TRP A 366
VAL A 369
SER A 399
 None
 1.45A 1zzuB-3gycA:
undetectable		 1zzuB-3gycA:
21.44
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.
3iha SALT-TOLERANT
GLUTAMINASE

(Micrococcus
luteus) 		PF04960
(Glutaminase) 		4 GLY A 260
GLN A  63
VAL A 199
SER A  66
 GLU  A 500 ( 3.8A)
GLU  A 500 (-3.4A)
None
None
 1.06A 1zzuB-3ihaA:
undetectable		 1zzuB-3ihaA:
20.08
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.
3mos TRANSKETOLASE

(Homo sapiens) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLY A 130
GLN A 127
VAL A 120
SER A  74
 None
EDO  A 619 (-3.7A)
None
None
 1.39A 1zzuB-3mosA:
1.2		 1zzuB-3mosA:
22.49
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.
3nzm DNA POLYMERASE III
SUBUNIT ALPHA

(Synechocystis
sp. PCC 6803) 		no annotation 4 GLY A 142
GLN A  46
TRP A  47
VAL A  22
 None
 1.18A 1zzuB-3nzmA:
undetectable		 1zzuB-3nzmA:
16.75
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.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLY A 309
GLN A 308
TRP A 405
VAL A 498
 CL  A 671 (-3.4A)
None
None
None
 1.16A 1zzuB-3ps9A:
undetectable		 1zzuB-3ps9A:
19.79
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.
3pvc TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Yersinia pestis) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLY A 309
GLN A 308
TRP A 408
VAL A 502
 CL  A 691 (-3.5A)
None
None
None
 1.10A 1zzuB-3pvcA:
undetectable		 1zzuB-3pvcA:
19.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qvf FOMA PROTEIN

(Streptomyces
wedmorensis) 		PF00696
(AA_kinase) 		4 GLY A  12
TRP A  86
VAL A  82
SER A 149
 FV1  A4001 ( 3.3A)
None
None
FV1  A4001 (-2.6A)
 1.45A 1zzuB-3qvfA:
undetectable		 1zzuB-3qvfA:
20.52
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.
3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE

(Klebsiella
pneumoniae) 		PF05035
(DGOK) 		4 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.37A 1zzuB-3r1xA:
undetectable		 1zzuB-3r1xA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rft URONATE
DEHYDROGENASE

(Agrobacterium
fabrum) 		PF01370
(Epimerase) 		4 GLY A 205
TRP A 204
VAL A 202
SER A 110
 None
 1.27A 1zzuB-3rftA:
undetectable		 1zzuB-3rftA:
19.95
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.
3t6d PHOTOSYNTHETIC
REACTION CENTER
M-SUBUNIT

(Blastochloris
viridis) 		PF00124
(Photo_RC) 		4 GLY M 125
TRP M 128
VAL M 131
SER M  54
 LDA  M 705 ( 3.7A)
None
BPB  M 402 ( 4.7A)
SO4  M 325 (-2.9A)
 1.21A 1zzuB-3t6dM:
0.7		 1zzuB-3t6dM:
20.98
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.
3tcm ALANINE
AMINOTRANSFERASE 2

(Hordeum vulgare) 		PF00155
(Aminotran_1_2) 		4 GLY A 300
GLN A 262
VAL A 346
SER A 296
 None
None
None
DCS  A 501 (-2.6A)
 1.46A 1zzuB-3tcmA:
undetectable		 1zzuB-3tcmA:
23.93
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.
3tfw PUTATIVE
O-METHYLTRANSFERASE

(Klebsiella
pneumoniae) 		PF01596
(Methyltransf_3) 		4 GLY A 216
GLN A 207
TRP A 214
VAL A 209
 None
 1.48A 1zzuB-3tfwA:
undetectable		 1zzuB-3tfwA:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3umf ADENYLATE KINASE

(Schistosoma
mansoni) 		PF00406
(ADK) 		4 GLY A  23
GLN A  25
VAL A  14
SER A  20
 None
 1.31A 1zzuB-3umfA:
undetectable		 1zzuB-3umfA:
18.72
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.
3wsu BETA-MANNANASE

(Streptomyces
thermolilacinus) 		PF00150
(Cellulase) 		4 GLY A 221
GLN A 220
TRP A 219
VAL A 248
 None
 1.43A 1zzuB-3wsuA:
undetectable		 1zzuB-3wsuA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4evw NUCLEOSIDE-DIPHOSPHA
TE-SUGAR
PYROPHOSPHORYLASE

(Vibrio cholerae) 		no annotation 4 GLY A 139
GLN A 138
VAL A 136
SER A 167
 None
 1.20A 1zzuB-4evwA:
undetectable		 1zzuB-4evwA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f3e CASA

(Thermus
thermophilus) 		PF09481
(CRISPR_Cse1) 		4 GLY A 343
GLN A 344
VAL A  51
SER A  45
 None
 1.17A 1zzuB-4f3eA:
2.1		 1zzuB-4f3eA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fbl LIPS LIPOLYTIC
ENZYME

(unidentified) 		PF12146
(Hydrolase_4) 		4 GLY A 137
GLN A 138
TRP A 134
VAL A 207
 None
 1.39A 1zzuB-4fblA:
undetectable		 1zzuB-4fblA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hcy THIAMINASE-I

(Naegleria
gruberi) 		no annotation 4 GLY A 252
GLN A 166
VAL A 332
SER A 119
 None
 1.47A 1zzuB-4hcyA:
undetectable		 1zzuB-4hcyA:
20.96
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.
4hqn SPOROZOITE SURFACE
PROTEIN 2

(Plasmodium
vivax) 		PF00090
(TSP_1)
PF00092
(VWA) 		4 GLY A 187
GLN A 188
VAL A 160
SER A  52
 None
None
None
MN  A 301 (-2.2A)
 1.43A 1zzuB-4hqnA:
1.3		 1zzuB-4hqnA:
21.11
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.
4ius GCN5-RELATED
N-ACETYLTRANSFERASE

(Kribbella
flavida) 		PF00583
(Acetyltransf_1) 		4 GLY A  14
GLN A  13
VAL A 182
SER A   9
 EDO  A 504 (-3.6A)
SO4  A 503 ( 3.3A)
EDO  A 504 (-4.8A)
None
 1.33A 1zzuB-4iusA:
undetectable		 1zzuB-4iusA:
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.
4k22 PROTEIN VISC

(Escherichia
coli) 		PF01494
(FAD_binding_3) 		4 GLY A  21
GLN A  23
VAL A  29
SER A  25
 None
 1.25A 1zzuB-4k22A:
undetectable		 1zzuB-4k22A:
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.
4mr0 PLASMIN AND
FIBRONECTIN-BINDING
PROTEIN A

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		4 GLY A 303
GLN A 302
VAL A 382
SER A 337
 None
 1.31A 1zzuB-4mr0A:
undetectable		 1zzuB-4mr0A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mwt LYSOSOMAL PROTECTIVE
PROTEIN

(Homo sapiens) 		PF00450
(Peptidase_S10) 		4 GLY A 379
GLN A 185
VAL A 384
SER A 181
 GLY  A 379 ( 0.0A)
GLN  A 185 ( 0.6A)
VAL  A 384 ( 0.6A)
SER  A 181 ( 0.0A)
 1.42A 1zzuB-4mwtA:
undetectable		 1zzuB-4mwtA:
20.86
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.
4ne4 ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN
(PROLINE/GLYCINE/BET
AINE)

(Agrobacterium
fabrum) 		PF04069
(OpuAC) 		4 GLY A 204
GLN A 258
VAL A 199
SER A 209
 None
 1.07A 1zzuB-4ne4A:
undetectable		 1zzuB-4ne4A:
21.71
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.
4onq DNA
METHYLTRANSFERASE

(Nicotiana
tabacum) 		PF00145
(DNA_methylase) 		4 GLY A 493
TRP A 524
VAL A 521
SER A 489
 SFG  A 700 (-3.6A)
None
None
None
 1.33A 1zzuB-4onqA:
undetectable		 1zzuB-4onqA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pel PENICILLIN G ACYLASE
SUBUNIT BETA

(Kluyvera
cryocrescens) 		PF01804
(Penicil_amidase) 		4 GLY B 343
GLN B 341
VAL B 442
SER B 325
 None
 1.32A 1zzuB-4pelB:
undetectable		 1zzuB-4pelB:
22.39
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.
4ukd URIDYLMONOPHOSPHATE/
CYTIDYLMONOPHOSPHATE
KINASE

(Dictyostelium
discoideum) 		PF00406
(ADK) 		4 GLY A  20
GLN A  22
VAL A  11
SER A  17
 ADP  A 195 (-3.7A)
None
None
ADP  A 195 (-3.7A)
 1.18A 1zzuB-4ukdA:
undetectable		 1zzuB-4ukdA:
18.05
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.
4w5k ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF00155
(Aminotran_1_2) 		4 GLY A 206
GLN A 211
VAL A 336
SER A 306
 None
 1.41A 1zzuB-4w5kA:
undetectable		 1zzuB-4w5kA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xmp HEAVY CHAIN OF
ANTIBODY VRC08

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 GLY H  95
GLN H 101
VAL H   2
SER H  97
 None
None
PCA  H   1 ( 3.3A)
None
 1.27A 1zzuB-4xmpH:
undetectable		 1zzuB-4xmpH:
22.20
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.
5anb ELONGATION FACTOR TU
GTP-BINDING
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF14492
(EFG_II) 		4 GLY K  95
GLN K 126
VAL K 130
SER K 100
 None
 1.40A 1zzuB-5anbK:
undetectable		 1zzuB-5anbK:
16.83
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.
5ddb MENIN

(Homo sapiens) 		PF05053
(Menin) 		4 GLY A  42
GLN A 141
VAL A  50
SER A 145
 None
 1.24A 1zzuB-5ddbA:
undetectable		 1zzuB-5ddbA:
21.85
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.
5drz HIV ANTIBODY F240
HEAVY CHAIN

(Homo sapiens) 		no annotation 4 GLY H 190
GLN H 192
VAL H 184
SER H 187
 None
 1.41A 1zzuB-5drzH:
undetectable		 1zzuB-5drzH:
21.23
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.
5e7p CELL DIVISION
CONTROL PROTEIN
CDC48

(Mycolicibacterium
smegmatis) 		PF00004
(AAA)
PF02359
(CDC48_N) 		4 GLY A 321
GLN A 220
VAL A 217
SER A 319
 None
 1.23A 1zzuB-5e7pA:
undetectable		 1zzuB-5e7pA:
19.07
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.
5f1y MCCC FAMILY PROTEIN

(Bacillus cereus) 		PF02016
(Peptidase_S66) 		4 GLY A  90
GLN A  91
VAL A 219
SER A  93
 None
 1.25A 1zzuB-5f1yA:
undetectable		 1zzuB-5f1yA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gxd AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Dinoroseobacter
shibae) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		4 GLY A 166
GLN A 200
VAL A 119
SER A 164
 None
 1.15A 1zzuB-5gxdA:
undetectable		 1zzuB-5gxdA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hlj VP24

(White spot
syndrome virus) 		PF12175
(WSS_VP) 		4 GLY A  81
GLN A  82
VAL A  65
SER A 100
 None
 1.39A 1zzuB-5hljA:
undetectable		 1zzuB-5hljA:
17.38
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.
5j98 VP2
VP3

(Slow bee
paralysis
virus;
Slow bee
paralysis virus) 		PF00073
(Rhv)
PF00073
(Rhv) 		4 GLY C  63
GLN B 158
VAL C  98
SER C 116
 None
 1.32A 1zzuB-5j98C:
undetectable		 1zzuB-5j98C:
21.07
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 GLY B 275
GLN B 277
TRP B 273
SER B 280
 None
 1.31A 1zzuB-5nd1B:
undetectable		 1zzuB-5nd1B:
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.
5trp DH272 FAB HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 GLY H 199
GLN H 201
VAL H 193
SER H 196
 None
 1.40A 1zzuB-5trpH:
undetectable		 1zzuB-5trpH:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u5i HTPA REDUCTASE

(Selaginella
moellendorffii) 		no annotation 4 GLY A 139
GLN A 141
VAL A 246
SER A 250
 None
 1.35A 1zzuB-5u5iA:
undetectable		 1zzuB-5u5iA:
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.
5v4b F-BOX/WD
REPEAT-CONTAINING
PROTEIN 7

(Homo sapiens) 		PF00400
(WD40)
PF12937
(F-box-like) 		4 GLY B2477
TRP B2486
VAL B2474
SER B2426
 None
 1.26A 1zzuB-5v4bB:
undetectable		 1zzuB-5v4bB:
20.71
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.
5vip MDCD

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		4 GLY B  83
GLN B  81
VAL B 121
SER B  89
 None
 1.41A 1zzuB-5vipB:
undetectable		 1zzuB-5vipB:
20.90
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.
5xaz GAMMA-BUTYROLACTONE
RECEPTOR PROTEIN

(Streptomyces
fradiae) 		PF00440
(TetR_N) 		4 GLY A 161
GLN A 163
VAL A 179
SER A 166
 None
 1.46A 1zzuB-5xazA:
undetectable		 1zzuB-5xazA:
21.96
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.
5xgu RIBONUCLEASE R

(Escherichia
coli) 		no annotation 4 GLY B 135
TRP B 547
VAL B 544
SER B 241
 None
 1.22A 1zzuB-5xguB:
undetectable		 1zzuB-5xguB:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xru ADENYLATE KINASE

(Notothenia
coriiceps) 		no annotation 4 GLY A  22
GLN A  24
VAL A  13
SER A  19
 AP5  A 201 (-3.5A)
None
None
AP5  A 201 (-3.5A)
 1.19A 1zzuB-5xruA:
undetectable		 1zzuB-5xruA:
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.
5xxs PROTEIN RIBT

(Bacillus
subtilis) 		no annotation 4 GLY A  83
GLN A  85
TRP A  47
VAL A  54
 COA  A 200 (-3.6A)
None
None
None
 1.25A 1zzuB-5xxsA:
undetectable		 1zzuB-5xxsA:
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.
5yfp EXOCYST COMPLEX
COMPONENT SEC6

(Saccharomyces
cerevisiae) 		no annotation 4 GLY C 588
GLN C 594
VAL C 647
SER C 549
 None
 1.34A 1zzuB-5yfpC:
2.0		 1zzuB-5yfpC:
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.
6cgm RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Bacillus
subtilis) 		no annotation 4 GLY A 651
GLN A 650
VAL A 364
SER A 379
 None
 1.42A 1zzuB-6cgmA:
1.4		 1zzuB-6cgmA:
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.
6gk7 HUMAN FAB ANTIBODY
FRAGMENT OF
CBTAU-27.1(S31Y,T100
I)

(Homo sapiens) 		no annotation 4 GLY H 199
GLN H 201
VAL H 193
SER H 196
 None
CL  H 302 (-4.4A)
None
None
 1.47A 1zzuB-6gk7H:
undetectable		 1zzuB-6gk7H:
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.
6gup -

(-) 		no annotation 4 GLN A 172
TRP A 291
VAL A 292
SER A 166
 None
 1.35A 1zzuB-6gupA:
undetectable		 1zzuB-6gupA:
undetectable