Receptor
PDB id Resolution Class Description Source Keywords
6QRF 1.86 Å EC: 2.1.1.228 CRYSTAL STRUCTURE OF TRMD, A TRNA-(N1G37) METHYLTRANSFERASE, MYCOBACTERIUM ABSCESSUS IN COMPLEX WITH INHIBITOR MYCOBACTERIUM ABSCESSUS TRMD TRNA METHYLTRANSFERASE SPOUT METHYLTRANSFERASE TRANS
Ref.: DEVELOPMENT OF INHIBITORS AGAINSTMYCOBACTERIUM ABSC (M1G37) METHYLTRANSFERASE (TRMD) USING FRAGMENT-BAS APPROACHES. J.MED.CHEM. V. 62 7210 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
JF5 B:301;
A:301;
A:302;
A:303;
 Valid;
Valid;
Valid;
Valid;
 none;
none;
none;
none;
 Kd = 33 uM
202.209 C11 H10 N2 O2 c1ccc...
SO4 B:302;
 Invalid;
 none;
 submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6QRB 1.66 Å EC: 2.1.1.228 CRYSTAL STRUCTURE OF TRMD, A TRNA-(N1G37) METHYLTRANSFERASE, MYCOBACTERIUM ABSCESSUS IN COMPLEX WITH INHIBITOR MYCOBACTERIUM ABSCESSUS TRMD TRNA METHYLTRANSFERASE SPOUT METHYLTRANSFERASE TRANS
Ref.: DEVELOPMENT OF INHIBITORS AGAINST MYCOBACTERIUM ABS TRNA (M 1 G37) METHYLTRANSFERASE (TRMD) USING FRAGM APPROACHES. J.MED.CHEM. V. 62 7210 2019
Members (54)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 6QQR - JDN C8 H8 B N O2 B(c1ccc2c(....
2 6QOA - JBN C4 H4 N2 O2 c1cnoc1C(=....
3 6QOF - ADE C5 H5 N5 c1[nH]c2c(....
4 6QQY Kd = 0.5 uM JD2 C18 H14 N6 c1ccnc(c1)....
5 6QRF Kd = 33 uM JF5 C11 H10 N2 O2 c1ccc(cc1)....
6 6QOJ - JBH C8 H8 N2 O c1ccc2c(c1....
7 6QR5 Kd = 0.49 uM JFH C23 H25 N5 c1cc(ccc1C....
8 6QOR - JBK C6 H6 N2 O3 c1cc(c(c(c....
9 6QON - J9W C8 H5 N O3 c1ccc2c(c1....
10 6QOO - JAB C4 H4 N2 O S c1cnoc1C(=....
11 6QOK - J9T C7 H8 N2 O2 COC(=O)c1c....
12 6QR6 Kd = 0.027 uM JCK C24 H24 N6 c1cc(ccc1C....
13 6QQS Kd = 110 uM JCZ C11 H10 N4 c1cc(cc2c1....
14 6QQZ Kd = 0.18 uM JEB C18 H14 N6 c1cc(cnc1)....
15 6QO4 - 97T C9 H7 N O2 c1ccc(c(c1....
16 6QQW Kd = 19 uM JDQ C18 H16 N4 c1ccc(cc1)....
17 6QQT Kd = 59 uM JCH C19 H18 N4 O COc1ccc(cc....
18 6QQQ Kd = 6.7 uM JDE C17 H15 N3 O3 COc1cc(cc(....
19 6QOC - J9Q C9 H8 N2 O c1ccc(c(c1....
20 6NW6 - SAM C15 H22 N6 O5 S C[S@@+](CC....
21 6QO3 - J9N C7 H7 N3 S c1cc(sc1)C....
22 6QR7 Kd = 70 nM JEK C25 H26 N6 c1cc(ccc1C....
23 6QOT Kd = 0.17 mM 6SD C10 H11 N3 O COc1ccc(cc....
24 6QR0 Kd = 0.12 uM JFB C18 H14 N6 c1cc(cc2c1....
25 6QR9 Kd = 190 nM JEE C24 H24 N6 O c1cc(ccc1C....
26 6QOQ - JAE C7 H6 N2 S c1cc2c(cc1....
27 6QOD - FBB C7 H5 F N2 S c1cc2c(cc1....
28 6QOV - JAH C12 H12 N2 c1ccc(cc1)....
29 6QR1 Kd = 8.5 uM JFT C18 H13 Cl N6 c1cc(cnc1)....
30 6QOI - ABV C7 H6 N2 S c1ccc2c(c1....
31 6QRC Kd = 13 uM JFE C19 H18 N4 O COc1cccc(c....
32 6QOW - JBZ C9 H7 N O3 S COc1ccc2c(....
33 6QRE Kd = 14 uM JCQ C12 H12 N2 O3 COc1cccc(c....
34 6QOX - JA5 C9 H9 N O3 S COC(=O)c1c....
35 6QOG - JA8 C7 H5 Br N2 S c1cc2c(cc1....
36 6QR2 Kd = 3.2 uM JQB C18 H14 N6 O c1cc(c(nc1....
37 6QQV Kd = 12 uM JEW C19 H15 N5 c1ccc(c(c1....
38 6NW7 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
39 6QRA Kd = 710 nM JDK C24 H27 N5 c1cc(ccc1C....
40 6QOS - GOJ C6 H8 N2 O2 CCOC(=O)c1....
41 6QRB Kd = 27 nM JEQ C25 H26 N6 c1ccc(cc1)....
42 6QR8 Kd = 0.073 uM JDH C25 H27 N7 CN1CCN(CC1....
43 6QO6 - 5OB C8 H8 N2 O COc1ccc2c(....
44 6QRD Kd = 100 nM JEH C27 H31 N7 CC(C)N1CCN....
45 6QOH - 6GU C5 H4 Cl N5 c1[nH]c2c(....
46 6QOP - JBQ C8 H7 F N2 O c1cc2c(c(c....
47 6QR3 Kd = 0.36 uM JE8 C19 H22 N6 CN1CCC[C@@....
48 6QOL - JB5 C8 H7 N3 c1cc2c(cc1....
49 6QQU Kd = 5 uM JF8 C12 H9 N5 c1cc(cc2c1....
50 6QOM - JBE C5 H5 N3 O2 c1cc(c(nc1....
51 6QRG Kd = 10 uM JET C14 H14 N2 O5 COC(=O)COc....
52 6QR4 Kd = 0.59 uM JD8 C19 H22 N6 CN1CCCC[C@....
53 6QO2 - JAW C9 H8 N2 O c1cc2c(cc[....
54 6QOU Kd = 0.26 mM JB8 C8 H8 B N O2 B(c1ccc2cc....
70% Homology Family (58)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 6QQR - JDN C8 H8 B N O2 B(c1ccc2c(....
2 6QOA - JBN C4 H4 N2 O2 c1cnoc1C(=....
3 6QOF - ADE C5 H5 N5 c1[nH]c2c(....
4 6QQY Kd = 0.5 uM JD2 C18 H14 N6 c1ccnc(c1)....
5 6QRF Kd = 33 uM JF5 C11 H10 N2 O2 c1ccc(cc1)....
6 6QOJ - JBH C8 H8 N2 O c1ccc2c(c1....
7 6QR5 Kd = 0.49 uM JFH C23 H25 N5 c1cc(ccc1C....
8 6QOR - JBK C6 H6 N2 O3 c1cc(c(c(c....
9 6QON - J9W C8 H5 N O3 c1ccc2c(c1....
10 6QOO - JAB C4 H4 N2 O S c1cnoc1C(=....
11 6QOK - J9T C7 H8 N2 O2 COC(=O)c1c....
12 6QR6 Kd = 0.027 uM JCK C24 H24 N6 c1cc(ccc1C....
13 6QQS Kd = 110 uM JCZ C11 H10 N4 c1cc(cc2c1....
14 6QQZ Kd = 0.18 uM JEB C18 H14 N6 c1cc(cnc1)....
15 6QO4 - 97T C9 H7 N O2 c1ccc(c(c1....
16 6QQW Kd = 19 uM JDQ C18 H16 N4 c1ccc(cc1)....
17 6QQT Kd = 59 uM JCH C19 H18 N4 O COc1ccc(cc....
18 6QQQ Kd = 6.7 uM JDE C17 H15 N3 O3 COc1cc(cc(....
19 6QOC - J9Q C9 H8 N2 O c1ccc(c(c1....
20 6NW6 - SAM C15 H22 N6 O5 S C[S@@+](CC....
21 6QO3 - J9N C7 H7 N3 S c1cc(sc1)C....
22 6QR7 Kd = 70 nM JEK C25 H26 N6 c1cc(ccc1C....
23 6QOT Kd = 0.17 mM 6SD C10 H11 N3 O COc1ccc(cc....
24 6QR0 Kd = 0.12 uM JFB C18 H14 N6 c1cc(cc2c1....
25 6QR9 Kd = 190 nM JEE C24 H24 N6 O c1cc(ccc1C....
26 6QOQ - JAE C7 H6 N2 S c1cc2c(cc1....
27 6QOD - FBB C7 H5 F N2 S c1cc2c(cc1....
28 6QOV - JAH C12 H12 N2 c1ccc(cc1)....
29 6QR1 Kd = 8.5 uM JFT C18 H13 Cl N6 c1cc(cnc1)....
30 6QOI - ABV C7 H6 N2 S c1ccc2c(c1....
31 6QRC Kd = 13 uM JFE C19 H18 N4 O COc1cccc(c....
32 6QOW - JBZ C9 H7 N O3 S COc1ccc2c(....
33 6QRE Kd = 14 uM JCQ C12 H12 N2 O3 COc1cccc(c....
34 6QOX - JA5 C9 H9 N O3 S COC(=O)c1c....
35 6QOG - JA8 C7 H5 Br N2 S c1cc2c(cc1....
36 6QR2 Kd = 3.2 uM JQB C18 H14 N6 O c1cc(c(nc1....
37 6QQV Kd = 12 uM JEW C19 H15 N5 c1ccc(c(c1....
38 6NW7 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
39 6QRA Kd = 710 nM JDK C24 H27 N5 c1cc(ccc1C....
40 6QOS - GOJ C6 H8 N2 O2 CCOC(=O)c1....
41 6QRB Kd = 27 nM JEQ C25 H26 N6 c1ccc(cc1)....
42 6QR8 Kd = 0.073 uM JDH C25 H27 N7 CN1CCN(CC1....
43 6QO6 - 5OB C8 H8 N2 O COc1ccc2c(....
44 6QRD Kd = 100 nM JEH C27 H31 N7 CC(C)N1CCN....
45 6QOH - 6GU C5 H4 Cl N5 c1[nH]c2c(....
46 6QOP - JBQ C8 H7 F N2 O c1cc2c(c(c....
47 6QR3 Kd = 0.36 uM JE8 C19 H22 N6 CN1CCC[C@@....
48 6QOL - JB5 C8 H7 N3 c1cc2c(cc1....
49 6QQU Kd = 5 uM JF8 C12 H9 N5 c1cc(cc2c1....
50 6QOM - JBE C5 H5 N3 O2 c1cc(c(nc1....
51 6QRG Kd = 10 uM JET C14 H14 N2 O5 COC(=O)COc....
52 6QR4 Kd = 0.59 uM JD8 C19 H22 N6 CN1CCCC[C@....
53 6QO2 - JAW C9 H8 N2 O c1cc2c(cc[....
54 6QOU Kd = 0.26 mM JB8 C8 H8 B N O2 B(c1ccc2cc....
55 5ZHJ Kd = 10.1 uM SAH C14 H20 N6 O5 S c1nc(c2c(n....
56 5ZHL Kd = 0.19 uM 9D0 C23 H30 N4 O2 S CCCCCCCCNC....
57 5ZHK - 9D6 C23 H28 N4 O2 S CCN(Cc1ccc....
58 6JOF Kd = 10.4 uM BWR C20 H23 N5 O2 S c1cc(ccc1C....
50% Homology Family (69)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 6QQR - JDN C8 H8 B N O2 B(c1ccc2c(....
2 6QOA - JBN C4 H4 N2 O2 c1cnoc1C(=....
3 6QOF - ADE C5 H5 N5 c1[nH]c2c(....
4 6QQY Kd = 0.5 uM JD2 C18 H14 N6 c1ccnc(c1)....
5 6QRF Kd = 33 uM JF5 C11 H10 N2 O2 c1ccc(cc1)....
6 6QOJ - JBH C8 H8 N2 O c1ccc2c(c1....
7 6QR5 Kd = 0.49 uM JFH C23 H25 N5 c1cc(ccc1C....
8 6QOR - JBK C6 H6 N2 O3 c1cc(c(c(c....
9 6QON - J9W C8 H5 N O3 c1ccc2c(c1....
10 6QOO - JAB C4 H4 N2 O S c1cnoc1C(=....
11 6QOK - J9T C7 H8 N2 O2 COC(=O)c1c....
12 6QR6 Kd = 0.027 uM JCK C24 H24 N6 c1cc(ccc1C....
13 6QQS Kd = 110 uM JCZ C11 H10 N4 c1cc(cc2c1....
14 6QQZ Kd = 0.18 uM JEB C18 H14 N6 c1cc(cnc1)....
15 6QO4 - 97T C9 H7 N O2 c1ccc(c(c1....
16 6QQW Kd = 19 uM JDQ C18 H16 N4 c1ccc(cc1)....
17 6QQT Kd = 59 uM JCH C19 H18 N4 O COc1ccc(cc....
18 6QQQ Kd = 6.7 uM JDE C17 H15 N3 O3 COc1cc(cc(....
19 6QOC - J9Q C9 H8 N2 O c1ccc(c(c1....
20 6NW6 - SAM C15 H22 N6 O5 S C[S@@+](CC....
21 6QO3 - J9N C7 H7 N3 S c1cc(sc1)C....
22 6QR7 Kd = 70 nM JEK C25 H26 N6 c1cc(ccc1C....
23 6QOT Kd = 0.17 mM 6SD C10 H11 N3 O COc1ccc(cc....
24 6QR0 Kd = 0.12 uM JFB C18 H14 N6 c1cc(cc2c1....
25 6QR9 Kd = 190 nM JEE C24 H24 N6 O c1cc(ccc1C....
26 6QOQ - JAE C7 H6 N2 S c1cc2c(cc1....
27 6QOD - FBB C7 H5 F N2 S c1cc2c(cc1....
28 6QOV - JAH C12 H12 N2 c1ccc(cc1)....
29 6QR1 Kd = 8.5 uM JFT C18 H13 Cl N6 c1cc(cnc1)....
30 6QOI - ABV C7 H6 N2 S c1ccc2c(c1....
31 6QRC Kd = 13 uM JFE C19 H18 N4 O COc1cccc(c....
32 6QOW - JBZ C9 H7 N O3 S COc1ccc2c(....
33 6QRE Kd = 14 uM JCQ C12 H12 N2 O3 COc1cccc(c....
34 6QOX - JA5 C9 H9 N O3 S COC(=O)c1c....
35 6QOG - JA8 C7 H5 Br N2 S c1cc2c(cc1....
36 6QR2 Kd = 3.2 uM JQB C18 H14 N6 O c1cc(c(nc1....
37 6QQV Kd = 12 uM JEW C19 H15 N5 c1ccc(c(c1....
38 6NW7 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
39 6QRA Kd = 710 nM JDK C24 H27 N5 c1cc(ccc1C....
40 6QOS - GOJ C6 H8 N2 O2 CCOC(=O)c1....
41 6QRB Kd = 27 nM JEQ C25 H26 N6 c1ccc(cc1)....
42 6QR8 Kd = 0.073 uM JDH C25 H27 N7 CN1CCN(CC1....
43 6QO6 - 5OB C8 H8 N2 O COc1ccc2c(....
44 6QRD Kd = 100 nM JEH C27 H31 N7 CC(C)N1CCN....
45 6QOH - 6GU C5 H4 Cl N5 c1[nH]c2c(....
46 6QOP - JBQ C8 H7 F N2 O c1cc2c(c(c....
47 6QR3 Kd = 0.36 uM JE8 C19 H22 N6 CN1CCC[C@@....
48 6QOL - JB5 C8 H7 N3 c1cc2c(cc1....
49 6QQU Kd = 5 uM JF8 C12 H9 N5 c1cc(cc2c1....
50 6QOM - JBE C5 H5 N3 O2 c1cc(c(nc1....
51 6QRG Kd = 10 uM JET C14 H14 N2 O5 COC(=O)COc....
52 6QR4 Kd = 0.59 uM JD8 C19 H22 N6 CN1CCCC[C@....
53 6QO2 - JAW C9 H8 N2 O c1cc2c(cc[....
54 6QOU Kd = 0.26 mM JB8 C8 H8 B N O2 B(c1ccc2cc....
55 6JOE Kd = 0.091 uM BWR C20 H23 N5 O2 S c1cc(ccc1C....
56 4MCD ic50 = 4.7 uM 22L C12 H8 N2 O S c1ccc(cc1)....
57 3AXZ Kd = 372 uM ADN C10 H13 N5 O4 c1nc(c2c(n....
58 4MCC ic50 = 0.56 uM 21X C15 H14 N4 O2 S c1cc(ccc1C....
59 1UAK - SAM C15 H22 N6 O5 S C[S@@+](CC....
60 4YVH - SFG C15 H23 N7 O5 c1nc(c2c(n....
61 1UAL - SAH C14 H20 N6 O5 S c1nc(c2c(n....
62 1UAM - SAH C14 H20 N6 O5 S c1nc(c2c(n....
63 4YVG - SAM C15 H22 N6 O5 S C[S@@+](CC....
64 4MCB ic50 = 1.5 uM 21W C19 H18 N6 O2 S c1cc(ccc1C....
65 5ZHJ Kd = 10.1 uM SAH C14 H20 N6 O5 S c1nc(c2c(n....
66 5ZHL Kd = 0.19 uM 9D0 C23 H30 N4 O2 S CCCCCCCCNC....
67 5ZHK - 9D6 C23 H28 N4 O2 S CCN(Cc1ccc....
68 6JOF Kd = 10.4 uM BWR C20 H23 N5 O2 S c1cc(ccc1C....
69 1P9P Kd = 68 nM SAH C14 H20 N6 O5 S c1nc(c2c(n....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: JF5; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 JF5 1 1
2 GOJ 0.574468 0.878788
3 JCQ 0.566667 0.815789
4 JET 0.492754 0.72093
5 JDE 0.452055 0.756098
Similar Ligands (3D)
Ligand no: 1; Ligand: JF5; Similar ligands found: 568
No: Ligand Similarity coefficient
1 0OM 0.9847
2 BZM 0.9820
3 PZX 0.9819
4 5TO 0.9626
5 6C8 0.9619
6 6C5 0.9605
7 LVP 0.9600
8 6FG 0.9463
9 P93 0.9438
10 4AU 0.9437
11 6C4 0.9432
12 6C9 0.9419
13 6FR 0.9378
14 HLP 0.9371
15 5FL 0.9355
16 A7Q 0.9353
17 3CX 0.9348
18 9JH 0.9347
19 5F8 0.9344
20 RK4 0.9325
21 11X 0.9321
22 KPV 0.9319
23 XI7 0.9316
24 OJD 0.9314
25 TPM 0.9290
26 MKN 0.9290
27 4Z0 0.9282
28 D4G 0.9277
29 EXG 0.9275
30 DI9 0.9269
31 JGY 0.9268
32 8CC 0.9267
33 PHQ DAL 0.9266
34 S0B 0.9264
35 SOJ 0.9263
36 D25 0.9254
37 Q86 0.9249
38 QTV 0.9245
39 0QA 0.9244
40 ZZA 0.9243
41 EMU 0.9233
42 R7T 0.9227
43 HX8 0.9218
44 HPX 0.9215
45 REG 0.9211
46 G8V 0.9209
47 JMG 0.9204
48 1AJ 0.9203
49 FHV 0.9203
50 VM1 0.9203
51 5PV 0.9192
52 5B2 0.9190
53 NK5 0.9187
54 47V 0.9186
55 WDW 0.9184
56 PHQ ALA 0.9183
57 6NJ 0.9182
58 3IP 0.9176
59 BZQ 0.9176
60 AX5 0.9175
61 KLE 0.9170
62 F63 0.9167
63 D53 0.9167
64 L12 0.9165
65 0MB 0.9165
66 NFZ 0.9164
67 8CV 0.9161
68 E9P 0.9160
69 FPL 0.9160
70 CUQ 0.9158
71 G14 0.9157
72 SVG 0.9157
73 0UL 0.9156
74 S8P 0.9155
75 6DQ 0.9155
76 848 0.9155
77 4FF 0.9155
78 0DF 0.9152
79 FZ3 0.9147
80 S0A 0.9144
81 LR2 0.9139
82 0K7 0.9137
83 9JT 0.9136
84 TBJ 0.9135
85 6IP 0.9134
86 PIQ 0.9130
87 IPJ 0.9129
88 HH6 0.9129
89 BSA 0.9128
90 4RG 0.9128
91 1XS 0.9127
92 9VQ 0.9127
93 2D2 0.9127
94 A5H 0.9127
95 2L1 0.9126
96 4EU 0.9125
97 5TZ 0.9123
98 WCU 0.9121
99 KWV 0.9121
100 SCE 0.9120
101 A6W 0.9118
102 F40 0.9117
103 2E5 0.9115
104 A9B 0.9115
105 JVB 0.9113
106 LL1 0.9112
107 D26 0.9109
108 LL2 0.9108
109 22F 0.9106
110 A18 0.9104
111 DBE 0.9103
112 MJW 0.9096
113 H35 0.9095
114 RGK 0.9093
115 A8K 0.9092
116 BVS 0.9091
117 IDZ 0.9091
118 GB2 0.9090
119 833 0.9089
120 5E5 0.9084
121 F91 0.9083
122 RDV 0.9081
123 OGY 0.9080
124 IJ4 0.9075
125 JVD 0.9071
126 1YO 0.9070
127 JKK 0.9066
128 D1G 0.9065
129 0OP 0.9065
130 JSX 0.9065
131 M4N 0.9064
132 IJ1 0.9063
133 MJ5 0.9062
134 AVA 0.9062
135 SFY 0.9057
136 C4E 0.9056
137 2E6 0.9054
138 0V7 0.9054
139 68B 0.9054
140 0OO 0.9053
141 BSU 0.9052
142 B5A 0.9051
143 0LO 0.9050
144 MFY 0.9050
145 6MW 0.9048
146 J1K 0.9047
147 VBC 0.9041
148 L1T 0.9040
149 RAY 0.9036
150 DA2 0.9032
151 P7V 0.9031
152 S1D 0.9030
153 4JK 0.9029
154 IQQ 0.9027
155 4Z9 0.9024
156 5C1 0.9023
157 FCD 0.9023
158 HHV 0.9022
159 SZA 0.9021
160 S45 0.9021
161 272 0.9015
162 4FP 0.9015
163 28A 0.9015
164 3VQ 0.9014
165 UN3 0.9013
166 DCN 0.9012
167 TCR 0.9011
168 HAR 0.9006
169 531 0.9004
170 D2G 0.9001
171 5KJ 0.8997
172 SB7 0.8996
173 TRP 0.8996
174 7VY 0.8987
175 LIG 0.8987
176 M5P 0.8986
177 90G 0.8984
178 RKV 0.8984
179 3KJ 0.8984
180 S0F 0.8984
181 GHQ 0.8983
182 CH8 0.8983
183 J9Y 0.8983
184 69W 0.8982
185 NKI 0.8982
186 SSY 0.8981
187 OA5 0.8981
188 ZEA 0.8980
189 Q4G 0.8980
190 9CE 0.8980
191 YE6 0.8979
192 HRG 0.8979
193 MYT 0.8978
194 3GZ 0.8974
195 5VU 0.8974
196 FY8 0.8971
197 QTD 0.8970
198 3F4 0.8969
199 DA3 0.8968
200 0NX 0.8966
201 J4K 0.8965
202 78Y 0.8964
203 L5D 0.8963
204 AOY 0.8963
205 0V8 0.8963
206 PV4 0.8961
207 2QU 0.8961
208 0ON 0.8960
209 8OB 0.8958
210 5F5 0.8957
211 536 0.8957
212 IOP 0.8955
213 3C5 0.8955
214 Q9P 0.8955
215 20P 0.8955
216 49P 0.8952
217 AUV 0.8950
218 58X 0.8949
219 5S9 0.8948
220 4KJ 0.8948
221 4G2 0.8947
222 0QV 0.8946
223 LZ5 0.8946
224 MMJ 0.8945
225 U13 0.8945
226 37E 0.8941
227 RE4 0.8940
228 GNW 0.8940
229 KYN 0.8939
230 ARG 0.8935
231 S46 0.8933
232 DXK 0.8933
233 FC2 0.8931
234 ZEZ 0.8930
235 OA1 0.8930
236 T07 0.8929
237 SZ5 0.8929
238 CBE 0.8928
239 0QR 0.8927
240 27M 0.8926
241 2E4 0.8926
242 D8Y 0.8923
243 4GU 0.8922
244 SNJ 0.8920
245 H48 0.8918
246 API 0.8918
247 2J5 0.8917
248 245 0.8916
249 YTZ 0.8916
250 YIE 0.8915
251 GG8 0.8915
252 RNK 0.8914
253 5NR 0.8913
254 1OH 0.8911
255 S7V 0.8911
256 SE5 0.8911
257 0XR 0.8909
258 1HR 0.8907
259 PUE 0.8907
260 C6Z 0.8907
261 6JD 0.8905
262 I2E 0.8903
263 3D8 0.8903
264 TCL 0.8903
265 AX4 0.8902
266 7L4 0.8901
267 2P3 0.8899
268 HL6 0.8898
269 A6E 0.8897
270 3VR 0.8897
271 5H6 0.8895
272 HJD 0.8894
273 FCW 0.8894
274 DFL 0.8894
275 25F 0.8893
276 A9E 0.8893
277 5O5 0.8893
278 3IL 0.8892
279 YIH 0.8891
280 IAR 0.8891
281 1HP 0.8891
282 ISC 0.8891
283 GGB 0.8890
284 20D 0.8889
285 2OH 0.8887
286 HPK 0.8886
287 PFT 0.8886
288 C4F 0.8886
289 JA3 0.8885
290 ITW 0.8885
291 T03 0.8882
292 1FE 0.8882
293 U7E 0.8881
294 0OY 0.8881
295 U14 0.8880
296 W1G 0.8878
297 5R9 0.8877
298 60L 0.8877
299 ERZ 0.8876
300 3EB 0.8873
301 MW5 0.8871
302 C82 0.8870
303 4P9 0.8870
304 3IB 0.8867
305 4Z1 0.8865
306 JP5 0.8865
307 AEY 0.8863
308 RF2 0.8861
309 BGK 0.8861
310 1V1 0.8859
311 8OE 0.8859
312 KAP 0.8858
313 JE7 0.8857
314 0QX 0.8856
315 4MP 0.8856
316 VJJ 0.8854
317 1PS 0.8854
318 V15 0.8854
319 CDJ 0.8853
320 363 0.8851
321 7G2 0.8851
322 D1Y 0.8851
323 U12 0.8850
324 B41 0.8850
325 0FS 0.8850
326 EWG 0.8849
327 ODK 0.8849
328 NRG 0.8848
329 GJG 0.8847
330 X6W 0.8847
331 NAL 0.8845
332 P2L 0.8845
333 EAT 0.8844
334 2JX 0.8844
335 TVC 0.8843
336 A73 0.8842
337 LEL 0.8842
338 28B 0.8841
339 QME 0.8839
340 ENG 0.8839
341 W8L 0.8838
342 A51 0.8837
343 EQA 0.8835
344 LJ4 0.8833
345 6H2 0.8833
346 C0W 0.8829
347 9J6 0.8829
348 KLS 0.8828
349 LFQ 0.8826
350 EYJ 0.8824
351 2QV 0.8824
352 1CM 0.8823
353 STV 0.8820
354 1ER 0.8818
355 5WK 0.8817
356 3QO 0.8815
357 69K 0.8814
358 94X 0.8813
359 BC3 0.8812
360 P4L 0.8811
361 RGP 0.8809
362 HPF 0.8807
363 2GQ 0.8805
364 U4J 0.8804
365 II4 0.8802
366 Q92 0.8801
367 FT1 0.8800
368 SX2 0.8799
369 ALY 0.8797
370 I58 0.8792
371 E9S 0.8790
372 ILO 0.8788
373 WT2 0.8788
374 6QT 0.8785
375 TIA 0.8785
376 4WF 0.8785
377 GGG 0.8784
378 08D 0.8783
379 VFG 0.8782
380 ASE 0.8780
381 5NN 0.8778
382 8D6 0.8777
383 NBB 0.8777
384 JX7 0.8777
385 A6Z 0.8777
386 EXY 0.8777
387 TOH 0.8776
388 DAR 0.8775
389 LI7 0.8775
390 EV2 0.8774
391 Q2S 0.8774
392 6HN 0.8774
393 D3G 0.8773
394 ENO 0.8773
395 97K 0.8773
396 D9Z 0.8772
397 DDC 0.8772
398 DIH 0.8768
399 GVA 0.8767
400 VGS 0.8766
401 VFM 0.8766
402 MQR 0.8766
403 NIR 0.8762
404 4ZF 0.8761
405 DE7 0.8760
406 EGV 0.8760
407 4YZ 0.8759
408 RV1 0.8756
409 50Q 0.8752
410 F18 0.8750
411 TQL 0.8748
412 S0D 0.8748
413 IPL 0.8746
414 P4T 0.8746
415 EYY 0.8744
416 JOT 0.8744
417 WLH 0.8743
418 12R 0.8741
419 PML 0.8740
420 1A6 0.8739
421 C1E 0.8736
422 WDT 0.8733
423 7O4 0.8733
424 M3L 0.8732
425 OX3 0.8729
426 PQV 0.8727
427 2GA 0.8726
428 WA2 0.8723
429 H5E 0.8723
430 1V4 0.8721
431 LNN 0.8719
432 1V3 0.8719
433 EIP 0.8717
434 CWP 0.8714
435 HSA 0.8711
436 T21 0.8711
437 V2Z 0.8711
438 PTB 0.8711
439 88X 0.8710
440 EVO 0.8710
441 FT3 0.8709
442 7PS 0.8709
443 JCZ 0.8708
444 HKK 0.8708
445 VJP 0.8706
446 ZZU 0.8706
447 FB4 0.8702
448 4BX 0.8701
449 9XZ 0.8701
450 PHE ALA 0.8700
451 5KN 0.8700
452 X2M 0.8700
453 PRO GLY ALA 0.8699
454 6PG 0.8696
455 AP6 0.8695
456 GOE 0.8694
457 CW6 0.8692
458 795 0.8692
459 2LW 0.8689
460 WV7 0.8688
461 AZY 0.8688
462 VFJ 0.8688
463 XRS 0.8688
464 5R8 0.8688
465 7EH 0.8684
466 3G3 0.8683
467 YE7 0.8682
468 A6H 0.8681
469 2OX 0.8681
470 4AF 0.8680
471 TCT 0.8676
472 FT2 0.8676
473 RPN 0.8676
474 9ME 0.8675
475 TIZ 0.8674
476 BGT 0.8672
477 5SP 0.8671
478 L03 0.8670
479 2L2 0.8668
480 4CN 0.8666
481 2J3 0.8665
482 1KJ 0.8662
483 9RK 0.8661
484 Z3R 0.8661
485 OLU 0.8661
486 GXD 0.8660
487 CIR 0.8658
488 AHL 0.8658
489 TH4 0.8657
490 SB9 0.8657
491 G2V 0.8657
492 IAG 0.8654
493 FT6 0.8653
494 3GX 0.8653
495 XYS XYS 0.8653
496 TYP 0.8651
497 RES 0.8647
498 5ER 0.8647
499 8YH 0.8647
500 IXG 0.8646
501 AJ1 0.8642
502 NMM 0.8641
503 4YE 0.8641
504 TZM 0.8640
505 KCH 0.8640
506 CMG 0.8639
507 PMV 0.8638
508 7PJ 0.8637
509 5V0 0.8635
510 9VZ 0.8633
511 PPN 0.8633
512 RDM 0.8632
513 GNR 0.8632
514 P1J 0.8631
515 HWH 0.8631
516 RKY 0.8631
517 9X3 0.8631
518 9BF 0.8628
519 MT6 0.8628
520 27K 0.8627
521 G6Q 0.8627
522 R9G 0.8623
523 B2K 0.8622
524 36M 0.8621
525 3D3 0.8620
526 DMA 0.8618
527 XEV 0.8618
528 A06 0.8614
529 DP4 0.8614
530 Q8G 0.8612
531 1R5 0.8610
532 3XH 0.8609
533 RA7 0.8608
534 VIB 0.8607
535 LZ4 0.8604
536 2PK 0.8604
537 MD6 0.8603
538 J38 0.8601
539 QTJ 0.8601
540 AJG 0.8599
541 AX6 0.8596
542 5WN 0.8595
543 1OT 0.8585
544 AD6 0.8582
545 JF8 0.8582
546 1OX 0.8574
547 7R4 0.8574
548 6J5 0.8574
549 NIY 0.8570
550 LG6 0.8568
551 5M2 0.8565
552 613 0.8564
553 0X2 0.8563
554 492 0.8557
555 GVQ 0.8554
556 BBP 0.8554
557 M83 0.8554
558 NIF 0.8554
559 YZ9 0.8552
560 5LD 0.8549
561 NQ7 0.8544
562 7ZL 0.8542
563 S6P 0.8541
564 108 0.8540
565 TMG 0.8530
566 5LI 0.8528
567 HMZ 0.8523
568 4HG 0.8517
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6QRB; Ligand: JEQ; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 6qrb.bio1) has 36 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6QRB; Ligand: JEQ; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 6qrb.bio1) has 34 residues
No: Leader PDB Ligand Sequence Similarity
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