SIMILAR PATTERNS OF AMINO ACIDS FOR 3G1U_B_ADNB438_2

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.
1etz FAB NC10.14 - HEAVY
CHAIN

(Mus musculus) 		no annotation 3 THR H 123
GLU H 161
HIS H 212
 None
 0.75A 3g1uB-1etzH:
undetectable		 3g1uB-1etzH:
20.51
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.
1fh5 MONOCLONAL ANTIBODY
MAK33

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 117
GLU H 150
HIS H 201
 None
 0.83A 3g1uB-1fh5H:
undetectable		 3g1uB-1fh5H:
21.03
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.
1ii2 PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Trypanosoma
cruzi) 		PF01293
(PEPCK_ATP) 		3 THR A 162
GLU A 183
HIS A 117
 None
 0.78A 3g1uB-1ii2A:
undetectable		 3g1uB-1ii2A:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jgu ANTIBODY HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 148
HIS H 199
 None
 0.75A 3g1uB-1jguH:
undetectable		 3g1uB-1jguH:
19.49
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.
1lo3 IG GAMMA 2A HEAVY
CHAIN

(Mus musculus) 		no annotation 3 THR Y 116
GLU Y 154
HIS Y 205
 None
 0.78A 3g1uB-1lo3Y:
undetectable		 3g1uB-1lo3Y:
19.82
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.
1mdf 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 THR A  49
GLU A  55
HIS A 170
 None
 0.80A 3g1uB-1mdfA:
undetectable		 3g1uB-1mdfA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ndg IMMUNOGLOBULIN GAMMA
1 CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 410
GLU B 448
HIS B 510
 None
 0.83A 3g1uB-1ndgB:
undetectable		 3g1uB-1ndgB:
20.38
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.
1pg7 HUMANIZED ANTIBODY
D3H44

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 148
HIS H 200
 None
 0.71A 3g1uB-1pg7H:
undetectable		 3g1uB-1pg7H:
19.76
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.
1pzx HYPOTHETICAL PROTEIN
APC36103

(Geobacillus
stearothermophilus) 		PF02645
(DegV) 		3 THR A 230
GLU A 135
HIS A  21
 None
 0.82A 3g1uB-1pzxA:
2.4		 3g1uB-1pzxA:
20.62
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.
1t2q FAB NNA7 LIGHT CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 116
GLU H 154
HIS H 205
 None
 0.70A 3g1uB-1t2qH:
undetectable		 3g1uB-1t2qH:
19.55
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.
1uj3 IGG FAB HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 414
GLU B 452
HIS B 504
 None
 0.70A 3g1uB-1uj3B:
undetectable		 3g1uB-1uj3B:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uz8 IGG FAB (IGG3,
KAPPA) HEAVY CHAIN
291-2G3-A

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B  87
GLU B 148
HIS B 199
 None
 0.73A 3g1uB-1uz8B:
undetectable		 3g1uB-1uz8B:
20.23
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.
2a1f URIDYLATE KINASE

(Haemophilus
influenzae) 		PF00696
(AA_kinase) 		3 THR A 135
GLU A 152
HIS A 208
 None
 0.69A 3g1uB-2a1fA:
3.2		 3g1uB-2a1fA:
21.32
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.
2e3j EPOXIDE HYDROLASE
EPHB

(Mycobacterium
tuberculosis) 		PF00561
(Abhydrolase_1) 		3 THR A 190
GLU A 338
HIS A  45
 ACT  A2003 (-3.3A)
None
None
 0.78A 3g1uB-2e3jA:
5.3		 3g1uB-2e3jA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hnz REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H

(Human
immunodeficiency
virus 1) 		PF00075
(RNase_H)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		3 THR A 216
GLU A 203
HIS A 198
 None
 0.79A 3g1uB-2hnzA:
undetectable		 3g1uB-2hnzA:
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.
2v4y URIDYLATE KINASE

(Escherichia
coli) 		PF00696
(AA_kinase) 		3 THR A 138
GLU A 155
HIS A 211
 None
 0.77A 3g1uB-2v4yA:
3.1		 3g1uB-2v4yA:
20.50
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.
2vq1 ANTI-HUMAN FC GAMMA
RECEPTOR III 3G8
GAMMA HEAVY CHAIN
VARIABLE REGION

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B  87
GLU B 148
HIS B 199
 None
 0.84A 3g1uB-2vq1B:
undetectable		 3g1uB-2vq1B:
19.82
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.
2ypv FAB 12C1

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 116
GLU H 154
HIS H 205
 None
 0.71A 3g1uB-2ypvH:
undetectable		 3g1uB-2ypvH:
19.05
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.
3a9g PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrobaculum
aerophilum) 		PF07995
(GSDH) 		3 THR A 256
GLU A 232
HIS A 152
 None
CA  A1001 ( 4.6A)
None
 0.79A 3g1uB-3a9gA:
undetectable		 3g1uB-3a9gA:
24.00
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.
3b9k FAB HEAVY CHAIN

(Rattus rattus) 		no annotation 3 THR H 110
GLU H 150
HIS H 212
 None
 0.79A 3g1uB-3b9kH:
undetectable		 3g1uB-3b9kH:
18.20
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.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		3 THR A 204
GLU A 182
HIS A 185
 None
 0.78A 3g1uB-3cttA:
undetectable		 3g1uB-3cttA:
18.12
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.
3cvh 25-D1.16 HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 117
GLU H 155
HIS H 206
 None
 0.79A 3g1uB-3cvhH:
undetectable		 3g1uB-3cvhH:
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.
3eo9 EFALIZUMAB FAB
FRAGMENT, HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 118
GLU H 156
HIS H 208
 None
 0.78A 3g1uB-3eo9H:
undetectable		 3g1uB-3eo9H:
20.40
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.
3epc PROTEIN VP1
PROTEIN VP2

(Enterovirus C) 		PF00073
(Rhv) 		3 THR 1  45
GLU 1  48
HIS 2 195
 None
 0.81A 3g1uB-3epc1:
undetectable		 3g1uB-3epc1:
20.70
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.
3epf PROTEIN VP1
PROTEIN VP2

(Enterovirus C) 		PF00073
(Rhv) 		3 THR 1  45
GLU 1  48
HIS 2 194
 None
 0.83A 3g1uB-3epf1:
undetectable		 3g1uB-3epf1:
19.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3glq ADENOSYLHOMOCYSTEINA
SE

(Burkholderia
pseudomallei) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 THR A  67
GLU A 199
HIS A 344
 RAB  A 602 (-4.5A)
RAB  A 602 (-4.6A)
RAB  A 602 ( 3.5A)
 0.44A 3g1uB-3glqA:
55.7		 3g1uB-3glqA:
55.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3h9u ADENOSYLHOMOCYSTEINA
SE

(Trypanosoma
brucei) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 THR A  57
GLU A 155
HIS A 300
 ADN  A 439 (-4.7A)
None
None
 0.18A 3g1uB-3h9uA:
62.6		 3g1uB-3h9uA:
85.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jz4 SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE
[NADP+]

(Escherichia
coli) 		PF00171
(Aldedh) 		3 THR A 234
GLU A 385
HIS A 342
 None
NAP  A 482 (-3.5A)
None
 0.84A 3g1uB-3jz4A:
5.0		 3g1uB-3jz4A:
21.64
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.
3mbh PUTATIVE
PHOSPHOMETHYLPYRIMID
INE KINASE

(Bacteroides
thetaiotaomicron) 		PF08543
(Phos_pyr_kin) 		3 THR A 258
GLU A 267
HIS A  48
 None
 0.80A 3g1uB-3mbhA:
5.5		 3g1uB-3mbhA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mck C705 MONOCLONAL
HEAVY CHAIN

(Mus musculus) 		no annotation 3 THR H 120
GLU H 158
HIS H 209
 None
 0.76A 3g1uB-3mckH:
undetectable		 3g1uB-3mckH:
20.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n58 ADENOSYLHOMOCYSTEINA
SE

(Brucella
abortus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 THR A  60
GLU A 192
HIS A 337
 ADN  A 500 (-4.6A)
ADN  A 500 (-3.6A)
ADN  A 500 ( 3.6A)
 0.16A 3g1uB-3n58A:
55.8		 3g1uB-3n58A:
58.65
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.
3ome ENOYL-COA HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		3 THR A 175
GLU A 151
HIS A 146
 None
 0.68A 3g1uB-3omeA:
undetectable		 3g1uB-3omeA:
20.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3one ADENOSYLHOMOCYSTEINA
SE

(Lupinus luteus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 THR A  67
GLU A 205
HIS A 350
 ADE  A 506 (-4.5A)
None
None
 0.20A 3g1uB-3oneA:
53.3		 3g1uB-3oneA:
58.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ria MOUSE MONOCLONAL FAB
FRAGMENT, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR F 119
GLU F 157
HIS F 208
 None
 0.76A 3g1uB-3riaF:
undetectable		 3g1uB-3riaF:
20.70
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.
3s35 6.64 FAB HEAVY CHAIN

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 114
GLU H 152
HIS H 203
 None
 0.74A 3g1uB-3s35H:
undetectable		 3g1uB-3s35H:
20.55
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.
3t3w ENOYL-COA HYDRATASE

(Mycolicibacterium
thermoresistibile) 		PF00378
(ECH_1) 		3 THR A 191
GLU A 167
HIS A 162
 None
 0.69A 3g1uB-3t3wA:
undetectable		 3g1uB-3t3wA:
20.56
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.
3tcl CH04 HEAVY CHAIN FAB

(Homo sapiens) 		no annotation 3 THR H 110
GLU H 148
HIS H 200
 None
 0.80A 3g1uB-3tclH:
undetectable		 3g1uB-3tclH:
21.62
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.
3tr1 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Coxiella
burnetii) 		PF00275
(EPSP_synthase) 		3 THR A 290
GLU A 288
HIS A 203
 None
 0.76A 3g1uB-3tr1A:
undetectable		 3g1uB-3tr1A:
23.83
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.
3ty2 5'-NUCLEOTIDASE SURE

(Coxiella
burnetii) 		PF01975
(SurE) 		3 THR A 224
GLU A 217
HIS A 192
 None
 0.71A 3g1uB-3ty2A:
5.1		 3g1uB-3ty2A:
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.
3ubx L363 HEAVY CHAIN
(IGHV9-4*02)

(Mus musculus) 		no annotation 3 THR H 117
GLU H 155
HIS H 206
 None
 0.83A 3g1uB-3ubxH:
undetectable		 3g1uB-3ubxH:
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.
3usc HYDROGENASE-1 LARGE
CHAIN

(Escherichia
coli) 		PF00374
(NiFeSe_Hases) 		3 THR L   3
GLU L 391
HIS L 351
 None
LI  L 604 ( 4.3A)
None
 0.81A 3g1uB-3uscL:
undetectable		 3g1uB-3uscL:
22.44
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.
3vfg 3F8 HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H  87
GLU H 148
HIS H 199
 None
 0.81A 3g1uB-3vfgH:
undetectable		 3g1uB-3vfgH:
20.77
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.
3vgp TRANSMEMBRANE
OLIGOSACCHARYL
TRANSFERASE,
PUTATIVE

(Archaeoglobus
fulgidus) 		no annotation 3 THR A 432
GLU A 521
HIS A 564
 None
 0.53A 3g1uB-3vgpA:
undetectable		 3g1uB-3vgpA:
17.51
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.
3vu0 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Archaeoglobus
fulgidus) 		no annotation 3 THR A 435
GLU A 524
HIS A 568
 None
 0.63A 3g1uB-3vu0A:
undetectable		 3g1uB-3vu0A:
17.51
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.
4dgy HCV1 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 148
HIS H 200
 None
CL  H 303 ( 4.6A)
None
 0.78A 3g1uB-4dgyH:
undetectable		 3g1uB-4dgyH:
19.58
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.
4duu PLASMINOGEN

(Homo sapiens) 		PF00024
(PAN_1)
PF00051
(Kringle)
PF00089
(Trypsin) 		3 THR A 369
GLU A 554
HIS A 569
 None
 0.64A 3g1uB-4duuA:
undetectable		 3g1uB-4duuA:
19.75
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.
4e9x MULTICOPPER OXIDASE

(uncultured
bacterium) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 THR A1137
GLU A1242
HIS A1208
 None
 0.82A 3g1uB-4e9xA:
undetectable		 3g1uB-4e9xA:
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.
4exl PHOSPHATE-BINDING
PROTEIN PSTS 1

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		3 THR A 166
GLU A  91
HIS A 236
 None
 0.68A 3g1uB-4exlA:
undetectable		 3g1uB-4exlA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ij3 HEAVY CHAIN OF FAB
FRAGMENT

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR C 115
GLU C 153
HIS C 204
 None
 0.74A 3g1uB-4ij3C:
undetectable		 3g1uB-4ij3C:
20.68
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.
4k0v TEK TYROSINE KINASE
VARIANT

(Homo sapiens) 		PF00041
(fn3)
PF10430
(Ig_Tie2_1) 		3 THR A 225
GLU A 381
HIS A 394
 None
 0.73A 3g1uB-4k0vA:
undetectable		 3g1uB-4k0vA:
21.63
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.
4k2u ANTIBODY HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 148
HIS H 199
 None
 0.77A 3g1uB-4k2uH:
undetectable		 3g1uB-4k2uH:
19.18
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.
4lu6 FLAVIN-DEPENDENT
TRYPTOPHAN
HALOGENASE REBH

(Lechevalieria
aerocolonigenes) 		PF04820
(Trp_halogenase) 		3 THR A 348
GLU A  49
HIS A 174
 PO4  A 601 (-3.4A)
None
None
 0.70A 3g1uB-4lu6A:
2.6		 3g1uB-4lu6A:
20.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lvc S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE)

(Bradyrhizobium
elkanii) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		3 THR A  63
GLU A 197
HIS A 342
 ADN  A 501 (-4.5A)
ADN  A 501 (-3.6A)
ADN  A 501 ( 3.7A)
 0.09A 3g1uB-4lvcA:
57.7		 3g1uB-4lvcA:
60.17
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.
4o26 TELOMERASE REVERSE
TRANSCRIPTASE

(Oryzias latipes) 		PF12009
(Telomerase_RBD) 		3 THR A 337
GLU A 564
HIS A 559
 None
None
SO4  A 605 (-3.7A)
 0.82A 3g1uB-4o26A:
undetectable		 3g1uB-4o26A:
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.
4ocs CAP256-VRC26.10
HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 148
HIS H 200
 None
 0.78A 3g1uB-4ocsH:
undetectable		 3g1uB-4ocsH:
21.28
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.
4pbq PUTATIVE TRAP
PERIPLASMIC SOLUTE
BINDING PROTEIN

(Haemophilus
influenzae) 		PF03480
(DctP) 		3 THR A 273
GLU A 266
HIS A  32
 None
 0.78A 3g1uB-4pbqA:
undetectable		 3g1uB-4pbqA:
21.73
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		3 THR A 275
GLU A 283
HIS A 286
 None
 0.80A 3g1uB-4qlbA:
2.4		 3g1uB-4qlbA:
20.50
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.
4wss HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		3 THR A  57
GLU A 397
HIS A 396
 None
 0.79A 3g1uB-4wssA:
undetectable		 3g1uB-4wssA:
19.85
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.
4x8j 12F4 FAB HEAVY CHAIN

(Mus musculus) 		no annotation 3 THR H 112
GLU H 150
HIS H 201
 None
 0.76A 3g1uB-4x8jH:
undetectable		 3g1uB-4x8jH:
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.
4ydv HIV ANTIBODY 7B2
HEAVY CHAIN,IGG H
CHAIN

(Homo sapiens) 		no annotation 3 THR H 110
GLU H 148
HIS H 200
 None
 0.78A 3g1uB-4ydvH:
undetectable		 3g1uB-4ydvH:
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.
4yr6 HEAVY CHAIN OF 5G6

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR A 117
GLU A 157
HIS A 208
 None
 0.82A 3g1uB-4yr6A:
undetectable		 3g1uB-4yr6A:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yr6 HEAVY CHAIN OF 5G6

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR A 119
GLU A 157
HIS A 208
 None
 0.83A 3g1uB-4yr6A:
undetectable		 3g1uB-4yr6A:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zso ANTIBODY HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 118
GLU B 156
HIS B 207
 None
 0.77A 3g1uB-4zsoB:
undetectable		 3g1uB-4zsoB:
18.33
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.
5b47 2-OXOACID--FERREDOXI
N OXIDOREDUCTASE
ALPHA SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01558
(POR)
PF01855
(POR_N)
PF17147
(PFOR_II) 		3 THR A 448
GLU A 472
HIS A 470
 None
 0.76A 3g1uB-5b47A:
3.2		 3g1uB-5b47A:
22.83
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.
5b71 SKY59 FAB HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 120
GLU B 158
HIS B 210
 None
 0.67A 3g1uB-5b71B:
undetectable		 3g1uB-5b71B:
19.09
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.
5d1q D2-06 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 110
GLU B 152
HIS B 204
 None
 0.76A 3g1uB-5d1qB:
undetectable		 3g1uB-5d1qB:
19.62
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.
5dq9 S55-3 FAB (IGG2B)
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR A  87
GLU A 148
HIS A 199
 None
 0.57A 3g1uB-5dq9A:
undetectable		 3g1uB-5dq9A:
20.05
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.
5drn FAB HPU24 HEAVY
CHAIN

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR A  87
GLU A 148
HIS A 197
 None
 0.77A 3g1uB-5drnA:
undetectable		 3g1uB-5drnA:
19.05
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.
5ds8 FAB HPU98 HEAVY
CHAIN

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR A  87
GLU A 148
HIS A 197
 EDO  A 303 (-4.6A)
EDO  A 303 (-3.6A)
None
 0.82A 3g1uB-5ds8A:
undetectable		 3g1uB-5ds8A:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e94 ANTIBODY FAB
FRAGMENT HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 120
GLU B 158
HIS B 210
 None
 0.83A 3g1uB-5e94B:
undetectable		 3g1uB-5e94B:
20.75
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.
5f9o CH235.9 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 119
GLU H 157
HIS H 209
 None
 0.83A 3g1uB-5f9oH:
undetectable		 3g1uB-5f9oH:
19.09
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.
5i8o HMM5 ANTIBODY HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H  88
GLU H 151
HIS H 203
 None
 0.80A 3g1uB-5i8oH:
undetectable		 3g1uB-5i8oH:
19.53
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.
5ila PROTEASE DO-LIKE 9

(Arabidopsis
thaliana) 		PF13365
(Trypsin_2) 		3 THR A 197
GLU A 172
HIS A 174
 None
 0.73A 3g1uB-5ilaA:
undetectable		 3g1uB-5ilaA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jq6 TEFIBAZUMAB FAB
FRAGMENT HEAVY CHAIN

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 118
GLU H 156
HIS H 208
 None
 0.81A 3g1uB-5jq6H:
undetectable		 3g1uB-5jq6H:
20.79
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.
5kvd ZV-2 ANTIBODY FAB
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 150
HIS H 212
 None
 0.80A 3g1uB-5kvdH:
undetectable		 3g1uB-5kvdH:
20.51
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.
5ldn ANTIBODY

(Mus musculus) 		no annotation 3 THR H 113
GLU H 151
HIS H 202
 None
 0.79A 3g1uB-5ldnH:
undetectable		 3g1uB-5ldnH:
19.50
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.
5m63 H CHAIN OF FAB
NVS-1-19-5

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 109
GLU H 179
HIS H 228
 None
 0.81A 3g1uB-5m63H:
undetectable		 3g1uB-5m63H:
20.45
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.
5mi0 MONOCLONAL ANTIBODY
9AD4

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR B 119
GLU B 157
HIS B 208
 None
 0.83A 3g1uB-5mi0B:
undetectable		 3g1uB-5mi0B:
21.28
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.
5odo ISOMERASE

(Rhodococcus
erythropolis) 		no annotation 3 THR A 104
GLU A  80
HIS A 541
 None
MG  A 610 ( 4.9A)
None
 0.71A 3g1uB-5odoA:
2.0		 3g1uB-5odoA:
21.82
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.
5ol2 ACYL-COA
DEHYDROGENASE

(Clostridioides
difficile) 		no annotation 3 THR C  28
GLU C 349
HIS C 337
 None
 0.83A 3g1uB-5ol2C:
undetectable		 3g1uB-5ol2C:
23.83
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.
5ovn POL PROTEIN

(Feline
immunodeficiency
virus) 		no annotation 3 THR A 215
GLU A 202
HIS A 197
 None
 0.75A 3g1uB-5ovnA:
undetectable		 3g1uB-5ovnA:
10.46
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT

(Xanthobacter
autotrophicus) 		PF02538
(Hydantoinase_B) 		3 THR A  14
GLU A 128
HIS A 134
 None
 0.56A 3g1uB-5svcA:
undetectable		 3g1uB-5svcA:
20.51
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.
5u3p DH511.4 FAB HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 THR H 110
GLU H 148
HIS H 200
 None
 0.70A 3g1uB-5u3pH:
undetectable		 3g1uB-5u3pH:
18.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u8s CELL DIVISION
CONTROL PROTEIN 45

(Saccharomyces
cerevisiae) 		PF02724
(CDC45) 		3 THR E 278
GLU E 426
HIS E 331
 None
 0.71A 3g1uB-5u8sE:
undetectable		 3g1uB-5u8sE:
20.58
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.
5vnc GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2

(Saccharomyces
cerevisiae) 		no annotation 3 THR A 246
GLU A 254
HIS A 257
 None
 0.77A 3g1uB-5vncA:
4.4		 3g1uB-5vncA:
11.65
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.
5wtf VP0
VP1

(Hepatovirus A) 		PF00073
(Rhv)
PF12944
(HAV_VP) 		3 THR A  53
GLU A  56
HIS B 146
 None
 0.82A 3g1uB-5wtfA:
undetectable		 3g1uB-5wtfA:
20.29
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.
5x5x FD CHAIN OF
ANTI-OSTEOCALCIN
ANTIBODY KTM219

(Mus musculus) 		no annotation 3 THR H 110
GLU H 148
HIS H 200
 None
 0.83A 3g1uB-5x5xH:
undetectable		 3g1uB-5x5xH:
10.83
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.
5xm3 GLUCOSE
DEHYDROGENASE

(Methylophaga
aminisulfidivorans) 		no annotation 3 THR A 216
GLU A 189
HIS A 163
 None
 0.79A 3g1uB-5xm3A:
undetectable		 3g1uB-5xm3A:
11.32
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.
5ywf 2H4 HEAVY CHAIN

(Mus musculus) 		no annotation 3 THR B 115
GLU B 153
HIS B 204
 None
 0.78A 3g1uB-5ywfB:
undetectable		 3g1uB-5ywfB:
10.98
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.
5ywo 2F2 HEAVY CHAIN

(Mus musculus) 		no annotation 3 THR N 115
GLU N 153
HIS N 204
 None
 0.82A 3g1uB-5ywoN:
undetectable		 3g1uB-5ywoN:
17.52
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.
6bo6 -

(-) 		no annotation 3 THR A 180
GLU A 310
HIS A 309
 None
 0.77A 3g1uB-6bo6A:
undetectable		 3g1uB-6bo6A:
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.
6c5v ANTIBODY FAB AMMO1
HEAVY CHAIN

(Homo sapiens) 		no annotation 3 THR H 116
GLU H 154
HIS H 206
 None
 0.77A 3g1uB-6c5vH:
undetectable		 3g1uB-6c5vH:
10.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c9m N-ALPHA-ACETYLTRANSF
ERASE 15, NATA
AUXILIARY SUBUNIT

(Homo sapiens) 		no annotation 3 THR A 469
GLU A 481
HIS A 514
 None
 0.82A 3g1uB-6c9mA:
undetectable		 3g1uB-6c9mA:
12.93
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.
6c9u HEAVY CHAIN OF FAB
1B2

(Homo sapiens) 		no annotation 3 THR H 117
GLU H 155
HIS H 207
 None
 0.75A 3g1uB-6c9uH:
undetectable		 3g1uB-6c9uH:
13.82
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.
6ca7 PCT64_13C HEAVY
CHAIN

(Homo sapiens) 		no annotation 3 THR H 110
GLU H 148
HIS H 200
 None
 0.79A 3g1uB-6ca7H:
undetectable		 3g1uB-6ca7H:
11.06
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.
6emz INT PROTEIN

(Enterococcus
faecalis) 		no annotation 3 THR A 222
GLU A 228
HIS A 248
 None
 0.82A 3g1uB-6emzA:
undetectable		 3g1uB-6emzA:
11.68
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.
6f3m -

(-) 		no annotation 3 THR B  66
GLU B 164
HIS B 323
 ADN  B 502 (-4.6A)
ADN  B 502 (-3.6A)
ZN  B 505 (-3.2A)
 0.12A 3g1uB-6f3mB:
54.6		 3g1uB-6f3mB:
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.
6gbn -

(-) 		no annotation 3 THR A  61
GLU A 159
HIS A 304
 ADN  A 501 (-4.6A)
ADN  A 501 (-3.9A)
ADN  A 501 ( 3.6A)
 0.11A 3g1uB-6gbnA:
59.8		 3g1uB-6gbnA:
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.
6h0e -

(-) 		no annotation 3 THR H 118
GLU H 156
HIS H 208
 None
 0.77A 3g1uB-6h0eH:
undetectable		 3g1uB-6h0eH:
undetectable