Receptor
PDB id Resolution Class Description Source Keywords
6E1Z 1.1 Å EC: 2.1.1.43 DISPLACEMENT OF WDR5 FROM CHROMATIN BY A PHARMACOLOGICAL WIN INHIBITOR WITH PICOMOLAR AFFINITY HOMO SAPIENS WDR5 WIN-SITE FRAGMENT SCREENING STRUCTURE-BASED DESIGN LINEAGE LEUKEMIA DNA BINDING PROTEIN DNA BINDING PROTEIN-COMPLEX GENE REGULATION GENE REGULATION-INHIBITOR COMPLEX
Ref.: DISPLACEMENT OF WDR5 FROM CHROMATIN BY A WIN SITE I WITH PICOMOLAR AFFINITY. CELL REP V. 26 2916 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
HLP A:401;
B:401;
 Valid;
Valid;
 none;
none;
 Kd = 150000 nM
192.171 C9 H8 N2 O3 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6UCS 1.85 Å EC: 2.1.1.43 DISCOVERY AND STRUCTURE-BASED OPTIMIZATION OF POTENT AND SEL WDR5 INHIBITORS CONTAINING A DIHYDROISOQUINOLINONE BICYCLIC HOMO SAPIENS WDR5 STRUCTURE-BASED DESIGN MIXED-LINEAGE LEUKEMIA TRANSC
Ref.: DISCOVERY AND STRUCTURE-BASED OPTIMIZATION OF POTEN SELECTIVE WD REPEAT DOMAIN 5 (WDR5) INHIBITORS CONT DIHYDROISOQUINOLINONE BICYCLIC CORE. J.MED.CHEM. V. 63 656 2020
Members (55)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 37 families.
1 2G99 - ALA ARG THR MLY GLN THR ALA ARG MLY SER n/a n/a
2 6E22 Kd = 1.3 nM HLS C20 H23 F N4 O3 COc1cc(cc(....
3 6UHZ - Q8D C13 H15 N3 O2 c1cc2c(cc1....
4 6PGA Kd = 28.9 uM OGM C10 H17 N3 O3 COC(=O)NCC....
5 6PG7 Kd = 22 uM OH4 C14 H18 N2 O2 CO[C@@H](C....
6 6DAI - G2V C15 H17 N3 CN1CCc2c1c....
7 6PG4 Kd = 260 uM OHG C5 H8 N2 O Cc1[nH]cc(....
8 6DY7 Kd = 66200 nM HH7 C12 H13 Cl2 N3 O c1cc(c(cc1....
9 6U8O Kd = 0.289 uM Q1G C17 H15 Br N2 O4 S c1cc(c(cc1....
10 6PG9 Kd = 12 uM OH1 C15 H19 N3 O2 c1ccc(cc1)....
11 2CNX - ALA ARG THR MLY GLN n/a n/a
12 3UVM Kd = 0.03 uM GLY ALA ALA ARG ALA GLU VAL TYR LEU ARG n/a n/a
13 6UCS Ki < 0.02 nM Q41 C30 H32 F N4 O3 Cc1cc(ccc1....
14 6UJJ - QBP C8 H5 F3 N4 c1cc(ccc1c....
15 6E1Y Kd = 22 nM HLM C19 H21 Cl N4 O C[C@@H](c1....
16 6PG5 Kd = 11 uM OHV C16 H21 N3 O3 c1ccc(cc1)....
17 2H6K Kd = 8.7 uM ALA ARG THR MLZ GLN THR ALA ARG LYS n/a n/a
18 6PGF - OJP C11 H17 N3 O2 C=CC(=O)NC....
19 6U6W Kd = 4.71 uM Q0Y C13 H11 Br Cl N O4 S COc1ccc(cc....
20 2H6Q Kd = 7.8 uM ALA ARG THR M3L GLN THR ALA ARG LYS n/a n/a
21 6PG6 Kd = 200 uM OH7 C10 H17 N3 O2 CC(=O)NCCC....
22 6PG8 Kd = 140 uM OGY C13 H16 N2 O c1ccc(cc1)....
23 6U80 Kd = 37 uM Q1J C19 H16 Br N O4 S COc1ccc(cc....
24 4Y7R Kd = 9.3 uM GLU GLU ILE ASP VAL VAL SER VAL n/a n/a
25 6DAK Ki = 7.21 uM G1Y C20 H19 N3 O c1ccc(cc1)....
26 6E23 Kd = 0.1 nM HLJ C25 H22 Cl2 F N5 O [H]/N=C/1N....
27 5SXM Kd = 2.9 nM ACE ALA ARG THR GLU VAL TYR NH2 n/a n/a
28 3PSL - ACE ALA ARG THR LYS GLN n/a n/a
29 6D9X Ki = 323 uM FZM C12 H12 N2 c1ccc(cc1)....
30 6U8B Kd = 0.431 uM Q1M C14 H11 Br Cl N O6 S COc1ccc(cc....
31 6DAS Ki = 8.37 nM G2D C24 H25 N3 O2 Cc1ccc(cc1....
32 6E1Z Kd = 150000 nM HLP C9 H8 N2 O3 c1cc(oc1Cn....
33 6UIF Kd = 0.17 uM Q8P C16 H18 Br Cl N4 O4 S CNC(=O)c1n....
34 6OI0 - ARG C6 H15 N4 O2 C(C[C@@H](....
35 6PGE Kd = 240 uM OJM C9 H14 N2 O3 CCOC(=O)CC....
36 6DAR Ki = 0.219 uM G2J C25 H27 N3 O2 COc1cccc(c....
37 5VFC ic50 = 0.9 nM 9BA C28 H44 N8 O5 [H]/N=C(NC....
38 6PGB Kd = 25 uM OJG C16 H21 N3 O2 c1ccc(cc1)....
39 6UHY - Q8G C14 H16 N2 O2 c1cc2c(cc1....
40 6U8L - Q1S C20 H21 N5 O2 CN1CCN(CC1....
41 6U5Y Kd = 0.069 uM Q0M C19 H17 Br Cl N3 O5 S CNC(=O)c1c....
42 6PGC Kd = 4.5 uM OJJ C17 H23 N3 O3 COC(=O)N(C....
43 2H13 Kd = 4.5 uM ALA ARG THR MLY GLN THR ALA ARG LYS SER n/a n/a
44 2H6N Kd = 1.02 uM ALA ARG THR MLY GLN THR ALA ARG LYS n/a n/a
45 6UOZ - QF1 C15 H17 Br Cl N3 O5 S2 CS(=O)(=O)....
46 6UFX Ki = 0.049 nM Q6S C28 H29 F N4 O3 [H]/N=C/1N....
47 6PGD - OK4 C19 H32 N6 O5 C[C@@H](C(....
48 6UJL - QBM C7 H11 N3 O S CCCSc1nc(c....
49 6UJ4 Kd = 0.17 uM Q8S C15 H17 Br Cl N3 O3 S Cc1nc(cn1C....
50 6OI2 - 2MR C8 H18 N4 O2 CN/C(=N/C)....
51 6UJH - QBS C10 H8 Cl N O CC(=O)[C@@....
52 6U5M Kd = 0.511 uM Q0S C13 H11 Br F5 N O5 S3 CS(=O)(=O)....
53 6UIK Kd = 0.4 uM Q8M C14 H15 Br Cl N3 O3 S c1c(cc(c(c....
54 6OI1 - NMM C7 H16 N4 O2 [H]/N=C(/N....
55 6PG3 Kd = 480 uM OHJ C8 H14 N2 O CCCCc1[nH]....
70% Homology Family (55)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 26 families.
1 2G99 - ALA ARG THR MLY GLN THR ALA ARG MLY SER n/a n/a
2 6E22 Kd = 1.3 nM HLS C20 H23 F N4 O3 COc1cc(cc(....
3 6UHZ - Q8D C13 H15 N3 O2 c1cc2c(cc1....
4 6PGA Kd = 28.9 uM OGM C10 H17 N3 O3 COC(=O)NCC....
5 6PG7 Kd = 22 uM OH4 C14 H18 N2 O2 CO[C@@H](C....
6 6DAI - G2V C15 H17 N3 CN1CCc2c1c....
7 6PG4 Kd = 260 uM OHG C5 H8 N2 O Cc1[nH]cc(....
8 6DY7 Kd = 66200 nM HH7 C12 H13 Cl2 N3 O c1cc(c(cc1....
9 6U8O Kd = 0.289 uM Q1G C17 H15 Br N2 O4 S c1cc(c(cc1....
10 6PG9 Kd = 12 uM OH1 C15 H19 N3 O2 c1ccc(cc1)....
11 2CNX - ALA ARG THR MLY GLN n/a n/a
12 3UVM Kd = 0.03 uM GLY ALA ALA ARG ALA GLU VAL TYR LEU ARG n/a n/a
13 6UCS Ki < 0.02 nM Q41 C30 H32 F N4 O3 Cc1cc(ccc1....
14 6UJJ - QBP C8 H5 F3 N4 c1cc(ccc1c....
15 6E1Y Kd = 22 nM HLM C19 H21 Cl N4 O C[C@@H](c1....
16 6PG5 Kd = 11 uM OHV C16 H21 N3 O3 c1ccc(cc1)....
17 2H6K Kd = 8.7 uM ALA ARG THR MLZ GLN THR ALA ARG LYS n/a n/a
18 6PGF - OJP C11 H17 N3 O2 C=CC(=O)NC....
19 6U6W Kd = 4.71 uM Q0Y C13 H11 Br Cl N O4 S COc1ccc(cc....
20 2H6Q Kd = 7.8 uM ALA ARG THR M3L GLN THR ALA ARG LYS n/a n/a
21 6PG6 Kd = 200 uM OH7 C10 H17 N3 O2 CC(=O)NCCC....
22 6PG8 Kd = 140 uM OGY C13 H16 N2 O c1ccc(cc1)....
23 6U80 Kd = 37 uM Q1J C19 H16 Br N O4 S COc1ccc(cc....
24 4Y7R Kd = 9.3 uM GLU GLU ILE ASP VAL VAL SER VAL n/a n/a
25 6DAK Ki = 7.21 uM G1Y C20 H19 N3 O c1ccc(cc1)....
26 6E23 Kd = 0.1 nM HLJ C25 H22 Cl2 F N5 O [H]/N=C/1N....
27 5SXM Kd = 2.9 nM ACE ALA ARG THR GLU VAL TYR NH2 n/a n/a
28 3PSL - ACE ALA ARG THR LYS GLN n/a n/a
29 6D9X Ki = 323 uM FZM C12 H12 N2 c1ccc(cc1)....
30 6U8B Kd = 0.431 uM Q1M C14 H11 Br Cl N O6 S COc1ccc(cc....
31 6DAS Ki = 8.37 nM G2D C24 H25 N3 O2 Cc1ccc(cc1....
32 6E1Z Kd = 150000 nM HLP C9 H8 N2 O3 c1cc(oc1Cn....
33 6UIF Kd = 0.17 uM Q8P C16 H18 Br Cl N4 O4 S CNC(=O)c1n....
34 6OI0 - ARG C6 H15 N4 O2 C(C[C@@H](....
35 6PGE Kd = 240 uM OJM C9 H14 N2 O3 CCOC(=O)CC....
36 6DAR Ki = 0.219 uM G2J C25 H27 N3 O2 COc1cccc(c....
37 5VFC ic50 = 0.9 nM 9BA C28 H44 N8 O5 [H]/N=C(NC....
38 6PGB Kd = 25 uM OJG C16 H21 N3 O2 c1ccc(cc1)....
39 6UHY - Q8G C14 H16 N2 O2 c1cc2c(cc1....
40 6U8L - Q1S C20 H21 N5 O2 CN1CCN(CC1....
41 6U5Y Kd = 0.069 uM Q0M C19 H17 Br Cl N3 O5 S CNC(=O)c1c....
42 6PGC Kd = 4.5 uM OJJ C17 H23 N3 O3 COC(=O)N(C....
43 2H13 Kd = 4.5 uM ALA ARG THR MLY GLN THR ALA ARG LYS SER n/a n/a
44 2H6N Kd = 1.02 uM ALA ARG THR MLY GLN THR ALA ARG LYS n/a n/a
45 6UOZ - QF1 C15 H17 Br Cl N3 O5 S2 CS(=O)(=O)....
46 6UFX Ki = 0.049 nM Q6S C28 H29 F N4 O3 [H]/N=C/1N....
47 6PGD - OK4 C19 H32 N6 O5 C[C@@H](C(....
48 6UJL - QBM C7 H11 N3 O S CCCSc1nc(c....
49 6UJ4 Kd = 0.17 uM Q8S C15 H17 Br Cl N3 O3 S Cc1nc(cn1C....
50 6OI2 - 2MR C8 H18 N4 O2 CN/C(=N/C)....
51 6UJH - QBS C10 H8 Cl N O CC(=O)[C@@....
52 6U5M Kd = 0.511 uM Q0S C13 H11 Br F5 N O5 S3 CS(=O)(=O)....
53 6UIK Kd = 0.4 uM Q8M C14 H15 Br Cl N3 O3 S c1c(cc(c(c....
54 6OI1 - NMM C7 H16 N4 O2 [H]/N=C(/N....
55 6PG3 Kd = 480 uM OHJ C8 H14 N2 O CCCCc1[nH]....
50% Homology Family (55)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 21 families.
1 2G99 - ALA ARG THR MLY GLN THR ALA ARG MLY SER n/a n/a
2 6E22 Kd = 1.3 nM HLS C20 H23 F N4 O3 COc1cc(cc(....
3 6UHZ - Q8D C13 H15 N3 O2 c1cc2c(cc1....
4 6PGA Kd = 28.9 uM OGM C10 H17 N3 O3 COC(=O)NCC....
5 6PG7 Kd = 22 uM OH4 C14 H18 N2 O2 CO[C@@H](C....
6 6DAI - G2V C15 H17 N3 CN1CCc2c1c....
7 6PG4 Kd = 260 uM OHG C5 H8 N2 O Cc1[nH]cc(....
8 6DY7 Kd = 66200 nM HH7 C12 H13 Cl2 N3 O c1cc(c(cc1....
9 6U8O Kd = 0.289 uM Q1G C17 H15 Br N2 O4 S c1cc(c(cc1....
10 6PG9 Kd = 12 uM OH1 C15 H19 N3 O2 c1ccc(cc1)....
11 2CNX - ALA ARG THR MLY GLN n/a n/a
12 3UVM Kd = 0.03 uM GLY ALA ALA ARG ALA GLU VAL TYR LEU ARG n/a n/a
13 6UCS Ki < 0.02 nM Q41 C30 H32 F N4 O3 Cc1cc(ccc1....
14 6UJJ - QBP C8 H5 F3 N4 c1cc(ccc1c....
15 6E1Y Kd = 22 nM HLM C19 H21 Cl N4 O C[C@@H](c1....
16 6PG5 Kd = 11 uM OHV C16 H21 N3 O3 c1ccc(cc1)....
17 2H6K Kd = 8.7 uM ALA ARG THR MLZ GLN THR ALA ARG LYS n/a n/a
18 6PGF - OJP C11 H17 N3 O2 C=CC(=O)NC....
19 6U6W Kd = 4.71 uM Q0Y C13 H11 Br Cl N O4 S COc1ccc(cc....
20 2H6Q Kd = 7.8 uM ALA ARG THR M3L GLN THR ALA ARG LYS n/a n/a
21 6PG6 Kd = 200 uM OH7 C10 H17 N3 O2 CC(=O)NCCC....
22 6PG8 Kd = 140 uM OGY C13 H16 N2 O c1ccc(cc1)....
23 6U80 Kd = 37 uM Q1J C19 H16 Br N O4 S COc1ccc(cc....
24 4Y7R Kd = 9.3 uM GLU GLU ILE ASP VAL VAL SER VAL n/a n/a
25 6DAK Ki = 7.21 uM G1Y C20 H19 N3 O c1ccc(cc1)....
26 6E23 Kd = 0.1 nM HLJ C25 H22 Cl2 F N5 O [H]/N=C/1N....
27 5SXM Kd = 2.9 nM ACE ALA ARG THR GLU VAL TYR NH2 n/a n/a
28 3PSL - ACE ALA ARG THR LYS GLN n/a n/a
29 6D9X Ki = 323 uM FZM C12 H12 N2 c1ccc(cc1)....
30 6U8B Kd = 0.431 uM Q1M C14 H11 Br Cl N O6 S COc1ccc(cc....
31 6DAS Ki = 8.37 nM G2D C24 H25 N3 O2 Cc1ccc(cc1....
32 6E1Z Kd = 150000 nM HLP C9 H8 N2 O3 c1cc(oc1Cn....
33 6UIF Kd = 0.17 uM Q8P C16 H18 Br Cl N4 O4 S CNC(=O)c1n....
34 6OI0 - ARG C6 H15 N4 O2 C(C[C@@H](....
35 6PGE Kd = 240 uM OJM C9 H14 N2 O3 CCOC(=O)CC....
36 6DAR Ki = 0.219 uM G2J C25 H27 N3 O2 COc1cccc(c....
37 5VFC ic50 = 0.9 nM 9BA C28 H44 N8 O5 [H]/N=C(NC....
38 6PGB Kd = 25 uM OJG C16 H21 N3 O2 c1ccc(cc1)....
39 6UHY - Q8G C14 H16 N2 O2 c1cc2c(cc1....
40 6U8L - Q1S C20 H21 N5 O2 CN1CCN(CC1....
41 6U5Y Kd = 0.069 uM Q0M C19 H17 Br Cl N3 O5 S CNC(=O)c1c....
42 6PGC Kd = 4.5 uM OJJ C17 H23 N3 O3 COC(=O)N(C....
43 2H13 Kd = 4.5 uM ALA ARG THR MLY GLN THR ALA ARG LYS SER n/a n/a
44 2H6N Kd = 1.02 uM ALA ARG THR MLY GLN THR ALA ARG LYS n/a n/a
45 6UOZ - QF1 C15 H17 Br Cl N3 O5 S2 CS(=O)(=O)....
46 6UFX Ki = 0.049 nM Q6S C28 H29 F N4 O3 [H]/N=C/1N....
47 6PGD - OK4 C19 H32 N6 O5 C[C@@H](C(....
48 6UJL - QBM C7 H11 N3 O S CCCSc1nc(c....
49 6UJ4 Kd = 0.17 uM Q8S C15 H17 Br Cl N3 O3 S Cc1nc(cn1C....
50 6OI2 - 2MR C8 H18 N4 O2 CN/C(=N/C)....
51 6UJH - QBS C10 H8 Cl N O CC(=O)[C@@....
52 6U5M Kd = 0.511 uM Q0S C13 H11 Br F5 N O5 S3 CS(=O)(=O)....
53 6UIK Kd = 0.4 uM Q8M C14 H15 Br Cl N3 O3 S c1c(cc(c(c....
54 6OI1 - NMM C7 H16 N4 O2 [H]/N=C(/N....
55 6PG3 Kd = 480 uM OHJ C8 H14 N2 O CCCCc1[nH]....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: HLP; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 HLP 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: HLP; Similar ligands found: 398
No: Ligand Similarity coefficient
1 6C9 0.9643
2 NFZ 0.9614
3 6C5 0.9568
4 9VQ 0.9474
5 0OO 0.9453
6 3EB 0.9447
7 MNP 0.9446
8 EXG 0.9410
9 JF5 0.9371
10 531 0.9370
11 A18 0.9354
12 I2E 0.9348
13 DTR 0.9343
14 J4K 0.9343
15 6FG 0.9330
16 S8P 0.9328
17 P93 0.9327
18 BZM 0.9326
19 11X 0.9309
20 TZM 0.9285
21 ITW 0.9281
22 JGY 0.9277
23 RK4 0.9270
24 6J5 0.9263
25 5O5 0.9261
26 2L1 0.9260
27 FPL 0.9253
28 PTB 0.9244
29 MJ5 0.9241
30 YIH 0.9240
31 848 0.9238
32 TRP 0.9235
33 R9G 0.9229
34 WCU 0.9221
35 VJJ 0.9215
36 GGB 0.9212
37 YIE 0.9210
38 PZX 0.9204
39 A7Q 0.9201
40 CH8 0.9200
41 0FR 0.9200
42 536 0.9195
43 4Z0 0.9192
44 HXY 0.9187
45 R7T 0.9178
46 GHQ 0.9171
47 22F 0.9156
48 3IP 0.9155
49 LL2 0.9142
50 SQV 0.9142
51 7VY 0.9139
52 ARG 0.9134
53 S7V 0.9133
54 E9P 0.9131
55 78U 0.9130
56 3IL 0.9130
57 F63 0.9126
58 XI7 0.9121
59 5TO 0.9119
60 S7D 0.9118
61 BB4 0.9117
62 B41 0.9111
63 QTV 0.9110
64 H35 0.9110
65 9W5 0.9101
66 KPV 0.9100
67 0OM 0.9098
68 LVP 0.9095
69 PPN 0.9092
70 54F 0.9092
71 TPM 0.9091
72 JX7 0.9091
73 S7G 0.9085
74 3IB 0.9079
75 DHC 0.9067
76 NAL 0.9066
77 VM1 0.9066
78 G8V 0.9062
79 GNW 0.9061
80 OJD 0.9060
81 9UL 0.9056
82 QME 0.9055
83 HHV 0.9055
84 N2Y 0.9053
85 B5A 0.9053
86 DAH 0.9050
87 SOJ 0.9045
88 NPA 0.9044
89 HX8 0.9044
90 HJD 0.9042
91 EYY 0.9040
92 14W 0.9037
93 FCW 0.9035
94 S0F 0.9032
95 DA3 0.9030
96 5WN 0.9024
97 4Z9 0.9022
98 HA6 0.9022
99 LEL 0.9022
100 26P 0.9021
101 EYJ 0.9019
102 23N 0.9011
103 IOP 0.9008
104 3W1 0.9005
105 HSA 0.8997
106 AVA 0.8987
107 9JH 0.8986
108 ISC 0.8986
109 TYR 0.8984
110 EUH 0.8983
111 1OH 0.8980
112 API 0.8976
113 L5D 0.8974
114 ING 0.8973
115 CSN 0.8972
116 4FP 0.8971
117 H48 0.8969
118 6FR 0.8960
119 NK5 0.8960
120 TEG 0.8956
121 OA1 0.8954
122 0QA 0.8954
123 4EU 0.8952
124 ZZU 0.8950
125 4BX 0.8948
126 ZEZ 0.8948
127 C6Z 0.8947
128 4WF 0.8945
129 U7E 0.8945
130 BL0 0.8944
131 EGV 0.8944
132 XEN 0.8943
133 ZIQ 0.8938
134 RVE 0.8937
135 BC3 0.8937
136 8XL 0.8933
137 1BN 0.8933
138 3VW 0.8931
139 BSA 0.8931
140 GVA 0.8929
141 M1T 0.8928
142 TQL 0.8927
143 XRX 0.8927
144 6C4 0.8926
145 ILO 0.8924
146 GJG 0.8923
147 0QV 0.8921
148 AHL 0.8919
149 0OL 0.8919
150 2L2 0.8918
151 X6P 0.8917
152 ZEA 0.8915
153 DCN 0.8914
154 3QO 0.8913
155 IAC 0.8913
156 OOG 0.8913
157 STX 0.8909
158 BZQ 0.8908
159 MD6 0.8906
160 MP5 0.8905
161 PPT 0.8905
162 OHJ 0.8903
163 ENO 0.8903
164 RE4 0.8903
165 L12 0.8902
166 Q9P 0.8900
167 5AD 0.8899
168 NIY 0.8899
169 YF3 0.8899
170 58X 0.8898
171 HAR 0.8897
172 4AF 0.8891
173 11C 0.8890
174 BZS 0.8889
175 96Z 0.8887
176 1QP 0.8886
177 9BF 0.8884
178 0OY 0.8881
179 TOH 0.8881
180 5DS 0.8879
181 27K 0.8877
182 3VR 0.8875
183 0OP 0.8873
184 TSR 0.8873
185 NWD 0.8873
186 N1Y 0.8872
187 SYE 0.8869
188 AHC 0.8868
189 5PV 0.8868
190 IOS 0.8864
191 EYV 0.8863
192 AZM 0.8863
193 QTS 0.8859
194 69K 0.8857
195 HWD 0.8856
196 535 0.8855
197 KYN 0.8852
198 MZM 0.8852
199 CUQ 0.8851
200 D1G 0.8851
201 0A1 0.8851
202 SBK 0.8850
203 657 0.8849
204 F90 0.8849
205 1PS 0.8848
206 SRO 0.8842
207 DBE 0.8841
208 YOF 0.8841
209 SB7 0.8839
210 RES 0.8839
211 NVU 0.8837
212 LJ4 0.8836
213 DAR 0.8836
214 5DL 0.8836
215 RDV 0.8834
216 N9J 0.8832
217 SZA 0.8832
218 IAR 0.8831
219 GGG 0.8828
220 IM4 0.8826
221 IYR 0.8825
222 ZON 0.8825
223 JA3 0.8823
224 2OH 0.8823
225 PMV 0.8822
226 DHY 0.8821
227 A8K 0.8821
228 DI9 0.8820
229 LTN 0.8820
230 AZY 0.8818
231 2J3 0.8818
232 PW1 0.8813
233 CFA 0.8812
234 5LD 0.8810
235 MMS 0.8810
236 CT0 0.8809
237 D3G 0.8807
238 3KJ 0.8807
239 4TB 0.8805
240 CTE 0.8804
241 M5H 0.8803
242 CIR 0.8799
243 2P3 0.8797
244 7Y3 0.8795
245 9J6 0.8795
246 D8Q 0.8794
247 RGP 0.8791
248 DTY 0.8790
249 M3Q 0.8790
250 FNA 0.8789
251 9X3 0.8789
252 CC5 0.8789
253 7N8 0.8787
254 TBJ 0.8782
255 8OE 0.8781
256 3NF 0.8776
257 3AK 0.8776
258 4JK 0.8772
259 EMU 0.8772
260 GAE 0.8771
261 6HO 0.8768
262 3XH 0.8767
263 GZ2 0.8767
264 V15 0.8766
265 2FX 0.8762
266 36M 0.8761
267 PAU 0.8758
268 2UB 0.8758
269 1YO 0.8753
270 FWD 0.8753
271 XRS 0.8752
272 BWD 0.8750
273 KAP 0.8749
274 MQB 0.8748
275 CWD 0.8748
276 AMR 0.8742
277 HJH 0.8740
278 DA2 0.8738
279 8OB 0.8735
280 EV2 0.8734
281 AC2 0.8734
282 EQW 0.8734
283 S0W 0.8733
284 W1G 0.8732
285 64Z 0.8730
286 3TC 0.8729
287 LGT 0.8729
288 DIH 0.8726
289 3HP 0.8725
290 HL6 0.8723
291 61M 0.8723
292 IPE 0.8723
293 4ZD 0.8722
294 YI6 0.8722
295 TCL 0.8721
296 PLR 0.8718
297 F91 0.8717
298 1HR 0.8716
299 D2G 0.8715
300 DEW 0.8714
301 2J5 0.8713
302 RNK 0.8712
303 QLI 0.8711
304 2O8 0.8710
305 LVD 0.8709
306 DLT 0.8708
307 FUZ 0.8708
308 GLY GLY GLY 0.8708
309 PUE 0.8707
310 QUS 0.8706
311 LTT 0.8704
312 MS0 0.8699
313 4CF 0.8698
314 NFM 0.8694
315 DX5 0.8694
316 HRG 0.8692
317 PHQ ALA 0.8686
318 WT2 0.8685
319 2N0 0.8682
320 K80 0.8679
321 IWD 0.8678
322 ATX 0.8672
323 1KN 0.8671
324 HPP 0.8671
325 PA5 0.8669
326 ISJ 0.8668
327 JCQ 0.8666
328 P2L 0.8665
329 AEY 0.8664
330 RLG 0.8664
331 5SP 0.8663
332 7BC 0.8659
333 5F1 0.8657
334 EYM 0.8657
335 6IP 0.8654
336 SE5 0.8654
337 C4E 0.8652
338 4A5 0.8650
339 FB4 0.8650
340 J9Y 0.8650
341 Q06 0.8649
342 PML 0.8649
343 NRG 0.8646
344 5RP 0.8646
345 QJA 0.8646
346 27M 0.8644
347 B15 0.8638
348 C4F 0.8636
349 AX8 0.8634
350 DTE 0.8633
351 F6R 0.8633
352 G6Q 0.8633
353 9E3 0.8630
354 2JX 0.8630
355 S46 0.8629
356 M3L 0.8626
357 5KJ 0.8626
358 SFY 0.8620
359 4AU 0.8619
360 AX5 0.8616
361 TMG 0.8615
362 4TP 0.8611
363 YE6 0.8606
364 KDG 0.8604
365 NIP 0.8604
366 12R 0.8604
367 6MW 0.8602
368 H4E 0.8602
369 VUR 0.8599
370 CX4 0.8599
371 4BF 0.8597
372 TX4 0.8593
373 PPY 0.8592
374 6JD 0.8591
375 PFF 0.8587
376 GRQ 0.8586
377 XQI 0.8585
378 3C4 0.8584
379 HCI 0.8578
380 37E 0.8578
381 ADN 0.8578
382 IPR 0.8577
383 A5P 0.8576
384 QBM 0.8570
385 PQZ 0.8565
386 FT2 0.8562
387 SCE 0.8559
388 EN1 0.8558
389 TL5 0.8553
390 CWP 0.8552
391 8V8 0.8551
392 7MX 0.8550
393 ARP 0.8543
394 3YP 0.8538
395 PBN 0.8532
396 ABF 0.8532
397 LLH 0.8528
398 DEZ 0.8517
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6UCS; Ligand: Q41; 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: 6ucs.bio2) has 31 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6UCS; Ligand: Q41; 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: 6ucs.bio1) has 38 residues
No: Leader PDB Ligand Sequence Similarity
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