Receptor
PDB id Resolution Class Description Source Keywords
225L 1.9 Å EC: 3.2.1.17 GENERATING LIGAND BINDING SITES IN T4 LYSOZYME USING DEFICIENCY-CREATING SUBSTITUTIONS ENTEROBACTERIA PHAGE T4 HYDROLASE O-GLYCOSYL T4 LYSOZYME CAVITY MUTANTS LIGAND BINDING PROTEIN ENGINEERING PROTEIN DESIGN
Ref.: GENERATION OF LIGAND BINDING SITES IN T4 LYSOZYME BY DEFICIENCY-CREATING SUBSTITUTIONS. J.MOL.BIOL. V. 277 467 1998
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BME A:901;
A:902;
Invalid;
Invalid;
none;
none;
submit data
78.133 C2 H6 O S C(CS)...
PXY A:169;
Valid;
none;
submit data
106.165 C8 H10 Cc1cc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
186L 1.8 Å EC: 3.2.1.17 SPECIFICITY OF LIGAND BINDING IN A BURIED NON-POLAR CAVITY OF T4 LYSOZYME: LINKAGE OF DYNAMICS AND STRUCTURAL P LASTICITY ENTEROBACTERIA PHAGE T4 HYDROLASE (O-GLYCOSYL)
Ref.: SPECIFICITY OF LIGAND BINDING IN A BURIED NONPOLAR CAVITY OF T4 LYSOZYME: LINKAGE OF DYNAMICS AND STRUCTURAL PLASTICITY. BIOCHEMISTRY V. 34 8576 1995
Members (78)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 15 families.
1 182L Ka = 8900 M^-1 BZF C8 H6 O c1ccc2c(c1....
2 3DN4 Ka = 51800 M^-1 PIH C6 H5 I c1ccc(cc1)....
3 1LI2 Kd = 91 uM IPH C6 H6 O c1ccc(cc1)....
4 3HH3 - B20 C4 H6 B N B1C=CC=CN1
5 1OVH - 2CM C7 H8 Cl N Cc1cccc(c1....
6 3HT6 Kd = 0.36 mM JZ0 C7 H8 O Cc1ccccc1O
7 3DMZ - HFB C6 F6 c1(c(c(c(c....
8 2OTZ Kd = 357 uM 1MR C7 H9 N CNc1ccccc1
9 1LI6 Ka = 6300 M^-1 5MP C5 H7 N Cc1cc[nH]c....
10 1L84 - BNZ C6 H6 c1ccccc1
11 3HUQ Kd = 0.25 mM J1Z C6 H4 S2 c1csc2c1sc....
12 3DMX Kd = 58.5 uM BNZ C6 H6 c1ccccc1
13 188L Kd = 469 uM OXE C8 H10 Cc1ccccc1C
14 3DN8 - IBF C6 F5 I c1(c(c(c(c....
15 3HT9 - JZ3 C7 H8 O2 COc1ccccc1....
16 3GUM Ka = 6610 M^-1 PXY C8 H10 Cc1ccc(cc1....
17 225L - PXY C8 H10 Cc1ccc(cc1....
18 181L Ka = 5700 M^-1 BNZ C6 H6 c1ccccc1
19 1OV5 - 2LP C9 H10 O C=CCc1cccc....
20 3DN3 Ka = 3330 M^-1 IBF C6 F5 I c1(c(c(c(c....
21 2RBN - 264 C8 H8 N2 c1ccc(cc1)....
22 1OV7 - LYL C10 H12 O Cc1cccc(c1....
23 2RBQ - 263 C8 H9 N3 Cc1cccc(c1....
24 2RB2 - 263 C8 H9 N3 Cc1cccc(c1....
25 2OTY Kd = 21 uM YAN C6 H4 Cl2 c1ccc(c(c1....
26 3RUN Kd = 3.6 uM MLU OMZ ASN GHP GHP OMY 3FG BGC RER n/a n/a
27 1LI3 Kd = 56 uM 3CH C6 H5 Cl O c1cc(cc(c1....
28 1LGX - 5AN C6 H5 F2 N c1c(cc(cc1....
29 1L83 Kd = 0.4 mM BNZ C6 H6 c1ccccc1
30 3HT8 Kd = 0.12 mM JZ2 C7 H7 Cl O Cc1ccc(cc1....
31 3DNA Ka = 40900 M^-1 PIH C6 H5 I c1ccc(cc1)....
32 2RBR - 268 C8 H10 O2 c1ccc(cc1)....
33 3HH6 - PYJ C8 H10 CCc1ccccc1
34 3GUL Ka = 22800 M^-1 PYJ C8 H10 CCc1ccccc1
35 184L Ka = 51000 M^-1 I4B C10 H14 CC(C)Cc1cc....
36 3GUO Ka = 9150 M^-1 IPH C6 H6 O c1ccc(cc1)....
37 3HTD - JZ5 C5 H5 N O S c1cc(sc1)C....
38 2RB1 - 261 C8 H10 O2 CCOc1ccccc....
39 3HTB Kd = 73.9 uM JZ4 C9 H12 O CCCc1ccccc....
40 1NHB Ka = 14800 M^-1 PYJ C8 H10 CCc1ccccc1
41 187L Kd = 422 uM PXY C8 H10 Cc1ccc(cc1....
42 2RAY - 258 C8 H9 Cl O c1ccc(cc1)....
43 3HUA Kd = 0.278 mM JZ9 C8 H11 N c1c[nH]c2c....
44 3DN2 - BBF C6 Br F5 c1(c(c(c(c....
45 2F47 Kd = 148 mM MGX C2 H7 N3 [H]N=C(N)N....
46 1OVJ - FLM C7 H8 F N Cc1c(cccc1....
47 2RBO - 265 C4 H3 N O2 S c1cc(sc1)[....
48 3DN0 - F5B C6 H F5 c1c(c(c(c(....
49 185L Kd = 289 uM IND C8 H7 N c1ccc2c(c1....
50 186L Kd = 14 uM N4B C10 H14 CCCCc1cccc....
51 3GUJ Ka = 37200 M^-1 BNZ C6 H6 c1ccccc1
52 3GUK Ka = 14100 M^-1 MBN C7 H8 Cc1ccccc1
53 3HU9 - NBE C6 H5 N O c1ccc(cc1)....
54 1LGW Kd = 100 uM 1AN C6 H6 F N c1ccc(c(c1....
55 3DN6 - F3B C6 Cl3 F3 c1(c(c(c(c....
56 2RB0 - 260 C7 H5 Br F2 c1cc(c(c(c....
57 2RBS - 269 C9 H11 Cl O c1ccc(cc1)....
58 2OU0 Kd = 592 uM MR3 C5 H7 N Cn1cccc1
59 3HH5 - B24 C6 H10 B N B1C=CC=CN1....
60 220L Kd = 1 mM BNZ C6 H6 c1ccccc1
61 1OVK - NYL C9 H11 N C=CCNc1ccc....
62 3HUK Kd = 0.35 mM J0Z C9 H10 O2 CC(=O)OCc1....
63 1XEP - CAQ C6 H6 O2 c1ccc(c(c1....
64 223L Kd = 0.4 mM BNZ C6 H6 c1ccccc1
65 3HTG - JZ7 C7 H12 O2 CCOC1CCC=C....
66 3GUP - 0PY C5 H5 N c1ccncc1
67 227L - BNZ C6 H6 c1ccccc1
68 3HT7 Kd = 0.28 mM JZ1 C8 H10 O CCc1ccccc1....
69 1OWY - PRY C9 H13 N CCCc1ccccc....
70 3DN1 - BCF C6 Cl F5 c1(c(c(c(c....
71 3HU8 Kd = 0.79 mM 261 C8 H10 O2 CCOc1ccccc....
72 3HTF - JZ6 C3 H3 Cl N2 c1c(cn[nH]....
73 183L Ka = 5170 M^-1 DEN C9 H8 c1ccc2c(c1....
74 2F32 Kd = 73 mM EGD C3 H9 N3 [H]N=C(N)N....
75 2RBP - 266 C5 H12 O S CCCSCCO
76 3HH4 - BNZ C6 H6 c1ccccc1
77 2RAZ - 259 C7 H7 N O2 S CSc1ccc(cc....
78 1OWZ - 4FA C8 H9 F O c1cc(ccc1C....
70% Homology Family (93)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 families.
1 182L Ka = 8900 M^-1 BZF C8 H6 O c1ccc2c(c1....
2 3DN4 Ka = 51800 M^-1 PIH C6 H5 I c1ccc(cc1)....
3 1LI2 Kd = 91 uM IPH C6 H6 O c1ccc(cc1)....
4 3HH3 - B20 C4 H6 B N B1C=CC=CN1
5 1OVH - 2CM C7 H8 Cl N Cc1cccc(c1....
6 3HT6 Kd = 0.36 mM JZ0 C7 H8 O Cc1ccccc1O
7 3DMZ - HFB C6 F6 c1(c(c(c(c....
8 2OTZ Kd = 357 uM 1MR C7 H9 N CNc1ccccc1
9 1LI6 Ka = 6300 M^-1 5MP C5 H7 N Cc1cc[nH]c....
10 1L84 - BNZ C6 H6 c1ccccc1
11 3HUQ Kd = 0.25 mM J1Z C6 H4 S2 c1csc2c1sc....
12 3DMX Kd = 58.5 uM BNZ C6 H6 c1ccccc1
13 188L Kd = 469 uM OXE C8 H10 Cc1ccccc1C
14 3DN8 - IBF C6 F5 I c1(c(c(c(c....
15 3HT9 - JZ3 C7 H8 O2 COc1ccccc1....
16 3GUM Ka = 6610 M^-1 PXY C8 H10 Cc1ccc(cc1....
17 225L - PXY C8 H10 Cc1ccc(cc1....
18 181L Ka = 5700 M^-1 BNZ C6 H6 c1ccccc1
19 1OV5 - 2LP C9 H10 O C=CCc1cccc....
20 3DN3 Ka = 3330 M^-1 IBF C6 F5 I c1(c(c(c(c....
21 2RBN - 264 C8 H8 N2 c1ccc(cc1)....
22 1OV7 - LYL C10 H12 O Cc1cccc(c1....
23 2RBQ - 263 C8 H9 N3 Cc1cccc(c1....
24 2RB2 - 263 C8 H9 N3 Cc1cccc(c1....
25 2OTY Kd = 21 uM YAN C6 H4 Cl2 c1ccc(c(c1....
26 3RUN Kd = 3.6 uM MLU OMZ ASN GHP GHP OMY 3FG BGC RER n/a n/a
27 1LI3 Kd = 56 uM 3CH C6 H5 Cl O c1cc(cc(c1....
28 1LGX - 5AN C6 H5 F2 N c1c(cc(cc1....
29 1L83 Kd = 0.4 mM BNZ C6 H6 c1ccccc1
30 3HT8 Kd = 0.12 mM JZ2 C7 H7 Cl O Cc1ccc(cc1....
31 3DNA Ka = 40900 M^-1 PIH C6 H5 I c1ccc(cc1)....
32 2RBR - 268 C8 H10 O2 c1ccc(cc1)....
33 3HH6 - PYJ C8 H10 CCc1ccccc1
34 3GUL Ka = 22800 M^-1 PYJ C8 H10 CCc1ccccc1
35 184L Ka = 51000 M^-1 I4B C10 H14 CC(C)Cc1cc....
36 3GUO Ka = 9150 M^-1 IPH C6 H6 O c1ccc(cc1)....
37 3HTD - JZ5 C5 H5 N O S c1cc(sc1)C....
38 2RB1 - 261 C8 H10 O2 CCOc1ccccc....
39 3HTB Kd = 73.9 uM JZ4 C9 H12 O CCCc1ccccc....
40 1NHB Ka = 14800 M^-1 PYJ C8 H10 CCc1ccccc1
41 187L Kd = 422 uM PXY C8 H10 Cc1ccc(cc1....
42 2RAY - 258 C8 H9 Cl O c1ccc(cc1)....
43 3HUA Kd = 0.278 mM JZ9 C8 H11 N c1c[nH]c2c....
44 3DN2 - BBF C6 Br F5 c1(c(c(c(c....
45 2F47 Kd = 148 mM MGX C2 H7 N3 [H]N=C(N)N....
46 1OVJ - FLM C7 H8 F N Cc1c(cccc1....
47 2RBO - 265 C4 H3 N O2 S c1cc(sc1)[....
48 3DN0 - F5B C6 H F5 c1c(c(c(c(....
49 185L Kd = 289 uM IND C8 H7 N c1ccc2c(c1....
50 186L Kd = 14 uM N4B C10 H14 CCCCc1cccc....
51 3GUJ Ka = 37200 M^-1 BNZ C6 H6 c1ccccc1
52 3GUK Ka = 14100 M^-1 MBN C7 H8 Cc1ccccc1
53 3HU9 - NBE C6 H5 N O c1ccc(cc1)....
54 1LGW Kd = 100 uM 1AN C6 H6 F N c1ccc(c(c1....
55 3DN6 - F3B C6 Cl3 F3 c1(c(c(c(c....
56 2RB0 - 260 C7 H5 Br F2 c1cc(c(c(c....
57 2RBS - 269 C9 H11 Cl O c1ccc(cc1)....
58 2OU0 Kd = 592 uM MR3 C5 H7 N Cn1cccc1
59 3HH5 - B24 C6 H10 B N B1C=CC=CN1....
60 220L Kd = 1 mM BNZ C6 H6 c1ccccc1
61 1OVK - NYL C9 H11 N C=CCNc1ccc....
62 3HUK Kd = 0.35 mM J0Z C9 H10 O2 CC(=O)OCc1....
63 1XEP - CAQ C6 H6 O2 c1ccc(c(c1....
64 223L Kd = 0.4 mM BNZ C6 H6 c1ccccc1
65 3HTG - JZ7 C7 H12 O2 CCOC1CCC=C....
66 3GUP - 0PY C5 H5 N c1ccncc1
67 227L - BNZ C6 H6 c1ccccc1
68 3HT7 Kd = 0.28 mM JZ1 C8 H10 O CCc1ccccc1....
69 1OWY - PRY C9 H13 N CCCc1ccccc....
70 3DN1 - BCF C6 Cl F5 c1(c(c(c(c....
71 3HU8 Kd = 0.79 mM 261 C8 H10 O2 CCOc1ccccc....
72 3HTF - JZ6 C3 H3 Cl N2 c1c(cn[nH]....
73 183L Ka = 5170 M^-1 DEN C9 H8 c1ccc2c(c1....
74 2F32 Kd = 73 mM EGD C3 H9 N3 [H]N=C(N)N....
75 2RBP - 266 C5 H12 O S CCCSCCO
76 3HH4 - BNZ C6 H6 c1ccccc1
77 2RAZ - 259 C7 H7 N O2 S CSc1ccc(cc....
78 1OWZ - 4FA C8 H9 F O c1cc(ccc1C....
79 4EKR - 0R0 C7 H5 N O c1ccc(c(c1....
80 4I7Q - 1DQ C4 H3 F3 N2 c1c([nH]cn....
81 4EKS - 0R1 C7 H5 N O c1ccc2c(c1....
82 4I7M Ka = 13900 M^-1 2LP C9 H10 O C=CCc1cccc....
83 4I7R - 1DU C5 H8 N2 O c1cnn(c1)C....
84 4I7J Kd = 480 uM BNZ C6 H6 c1ccccc1
85 4I7N - 1DJ C9 H8 O C#CC(c1ccc....
86 4I7K Kd = 905 uM MBN C7 H8 Cc1ccccc1
87 4I7T - 1DW C7 H5 Br O2 c1cc(c(cc1....
88 4EKP - NBZ C6 H5 N O2 c1ccc(cc1)....
89 4I7S - 1DV C5 H5 F3 N2 Cc1cc(n[nH....
90 4I7O - 1DH C3 H3 Cl N2 S c1c(sc(n1)....
91 4I7P Ka = 3155 M^-1 ES3 C3 H3 Br N2 c1c(nc[nH]....
92 4EKQ Kd = 2 uM NPO C6 H5 N O3 c1cc(ccc1[....
93 4I7L Kd = 103 uM IPH C6 H6 O c1ccc(cc1)....
50% Homology Family (93)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 182L Ka = 8900 M^-1 BZF C8 H6 O c1ccc2c(c1....
2 3DN4 Ka = 51800 M^-1 PIH C6 H5 I c1ccc(cc1)....
3 1LI2 Kd = 91 uM IPH C6 H6 O c1ccc(cc1)....
4 3HH3 - B20 C4 H6 B N B1C=CC=CN1
5 1OVH - 2CM C7 H8 Cl N Cc1cccc(c1....
6 3HT6 Kd = 0.36 mM JZ0 C7 H8 O Cc1ccccc1O
7 3DMZ - HFB C6 F6 c1(c(c(c(c....
8 2OTZ Kd = 357 uM 1MR C7 H9 N CNc1ccccc1
9 1LI6 Ka = 6300 M^-1 5MP C5 H7 N Cc1cc[nH]c....
10 1L84 - BNZ C6 H6 c1ccccc1
11 3HUQ Kd = 0.25 mM J1Z C6 H4 S2 c1csc2c1sc....
12 3DMX Kd = 58.5 uM BNZ C6 H6 c1ccccc1
13 188L Kd = 469 uM OXE C8 H10 Cc1ccccc1C
14 3DN8 - IBF C6 F5 I c1(c(c(c(c....
15 3HT9 - JZ3 C7 H8 O2 COc1ccccc1....
16 3GUM Ka = 6610 M^-1 PXY C8 H10 Cc1ccc(cc1....
17 225L - PXY C8 H10 Cc1ccc(cc1....
18 181L Ka = 5700 M^-1 BNZ C6 H6 c1ccccc1
19 1OV5 - 2LP C9 H10 O C=CCc1cccc....
20 3DN3 Ka = 3330 M^-1 IBF C6 F5 I c1(c(c(c(c....
21 2RBN - 264 C8 H8 N2 c1ccc(cc1)....
22 1OV7 - LYL C10 H12 O Cc1cccc(c1....
23 2RBQ - 263 C8 H9 N3 Cc1cccc(c1....
24 2RB2 - 263 C8 H9 N3 Cc1cccc(c1....
25 2OTY Kd = 21 uM YAN C6 H4 Cl2 c1ccc(c(c1....
26 3RUN Kd = 3.6 uM MLU OMZ ASN GHP GHP OMY 3FG BGC RER n/a n/a
27 1LI3 Kd = 56 uM 3CH C6 H5 Cl O c1cc(cc(c1....
28 1LGX - 5AN C6 H5 F2 N c1c(cc(cc1....
29 1L83 Kd = 0.4 mM BNZ C6 H6 c1ccccc1
30 3HT8 Kd = 0.12 mM JZ2 C7 H7 Cl O Cc1ccc(cc1....
31 3DNA Ka = 40900 M^-1 PIH C6 H5 I c1ccc(cc1)....
32 2RBR - 268 C8 H10 O2 c1ccc(cc1)....
33 3HH6 - PYJ C8 H10 CCc1ccccc1
34 3GUL Ka = 22800 M^-1 PYJ C8 H10 CCc1ccccc1
35 184L Ka = 51000 M^-1 I4B C10 H14 CC(C)Cc1cc....
36 3GUO Ka = 9150 M^-1 IPH C6 H6 O c1ccc(cc1)....
37 3HTD - JZ5 C5 H5 N O S c1cc(sc1)C....
38 2RB1 - 261 C8 H10 O2 CCOc1ccccc....
39 3HTB Kd = 73.9 uM JZ4 C9 H12 O CCCc1ccccc....
40 1NHB Ka = 14800 M^-1 PYJ C8 H10 CCc1ccccc1
41 187L Kd = 422 uM PXY C8 H10 Cc1ccc(cc1....
42 2RAY - 258 C8 H9 Cl O c1ccc(cc1)....
43 3HUA Kd = 0.278 mM JZ9 C8 H11 N c1c[nH]c2c....
44 3DN2 - BBF C6 Br F5 c1(c(c(c(c....
45 2F47 Kd = 148 mM MGX C2 H7 N3 [H]N=C(N)N....
46 1OVJ - FLM C7 H8 F N Cc1c(cccc1....
47 2RBO - 265 C4 H3 N O2 S c1cc(sc1)[....
48 3DN0 - F5B C6 H F5 c1c(c(c(c(....
49 185L Kd = 289 uM IND C8 H7 N c1ccc2c(c1....
50 186L Kd = 14 uM N4B C10 H14 CCCCc1cccc....
51 3GUJ Ka = 37200 M^-1 BNZ C6 H6 c1ccccc1
52 3GUK Ka = 14100 M^-1 MBN C7 H8 Cc1ccccc1
53 3HU9 - NBE C6 H5 N O c1ccc(cc1)....
54 1LGW Kd = 100 uM 1AN C6 H6 F N c1ccc(c(c1....
55 3DN6 - F3B C6 Cl3 F3 c1(c(c(c(c....
56 2RB0 - 260 C7 H5 Br F2 c1cc(c(c(c....
57 2RBS - 269 C9 H11 Cl O c1ccc(cc1)....
58 2OU0 Kd = 592 uM MR3 C5 H7 N Cn1cccc1
59 3HH5 - B24 C6 H10 B N B1C=CC=CN1....
60 220L Kd = 1 mM BNZ C6 H6 c1ccccc1
61 1OVK - NYL C9 H11 N C=CCNc1ccc....
62 3HUK Kd = 0.35 mM J0Z C9 H10 O2 CC(=O)OCc1....
63 1XEP - CAQ C6 H6 O2 c1ccc(c(c1....
64 223L Kd = 0.4 mM BNZ C6 H6 c1ccccc1
65 3HTG - JZ7 C7 H12 O2 CCOC1CCC=C....
66 3GUP - 0PY C5 H5 N c1ccncc1
67 227L - BNZ C6 H6 c1ccccc1
68 3HT7 Kd = 0.28 mM JZ1 C8 H10 O CCc1ccccc1....
69 1OWY - PRY C9 H13 N CCCc1ccccc....
70 3DN1 - BCF C6 Cl F5 c1(c(c(c(c....
71 3HU8 Kd = 0.79 mM 261 C8 H10 O2 CCOc1ccccc....
72 3HTF - JZ6 C3 H3 Cl N2 c1c(cn[nH]....
73 183L Ka = 5170 M^-1 DEN C9 H8 c1ccc2c(c1....
74 2F32 Kd = 73 mM EGD C3 H9 N3 [H]N=C(N)N....
75 2RBP - 266 C5 H12 O S CCCSCCO
76 3HH4 - BNZ C6 H6 c1ccccc1
77 2RAZ - 259 C7 H7 N O2 S CSc1ccc(cc....
78 1OWZ - 4FA C8 H9 F O c1cc(ccc1C....
79 4EKR - 0R0 C7 H5 N O c1ccc(c(c1....
80 4I7Q - 1DQ C4 H3 F3 N2 c1c([nH]cn....
81 4EKS - 0R1 C7 H5 N O c1ccc2c(c1....
82 4I7M Ka = 13900 M^-1 2LP C9 H10 O C=CCc1cccc....
83 4I7R - 1DU C5 H8 N2 O c1cnn(c1)C....
84 4I7J Kd = 480 uM BNZ C6 H6 c1ccccc1
85 4I7N - 1DJ C9 H8 O C#CC(c1ccc....
86 4I7K Kd = 905 uM MBN C7 H8 Cc1ccccc1
87 4I7T - 1DW C7 H5 Br O2 c1cc(c(cc1....
88 4EKP - NBZ C6 H5 N O2 c1ccc(cc1)....
89 4I7S - 1DV C5 H5 F3 N2 Cc1cc(n[nH....
90 4I7O - 1DH C3 H3 Cl N2 S c1c(sc(n1)....
91 4I7P Ka = 3155 M^-1 ES3 C3 H3 Br N2 c1c(nc[nH]....
92 4EKQ Kd = 2 uM NPO C6 H5 N O3 c1cc(ccc1[....
93 4I7L Kd = 103 uM IPH C6 H6 O c1ccc(cc1)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: PXY; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 PXY 1 1
2 MBN 0.4375 0.666667
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 186L; Ligand: N4B; Similar sites found: 94
This union binding pocket(no: 1) in the query (biounit: 186l.bio1) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc)
1 1DL2 NAG NAG BMA 0.0007211 0.45933
2 1VJ7 GPX 0.004922 0.44872
3 2VWA PTY 0.007281 0.44787
4 1XVB BBX 0.006554 0.44729
5 3KP6 SAL 0.004243 0.43828
6 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.009608 0.43677
7 3T7V MD0 0.006799 0.43645
8 3AQT RCO 0.008585 0.43583
9 2GN2 C5P 0.01208 0.43095
10 1XN0 ROL 0.007662 0.42893
11 1JGS SAL 0.006743 0.42889
12 1XN0 ROL 0.008167 0.42753
13 3T50 FMN 0.002446 0.42724
14 3T50 FMN 0.002446 0.42724
15 1GVE CIT 0.01042 0.42701
16 1OPK MYR 0.005623 0.42665
17 3TL1 JRO 0.01221 0.42323
18 1L0I PSR 0.01866 0.42155
19 1N9L FMN 0.003474 0.42054
20 1N9L FMN 0.003474 0.42054
21 1N9L FMN 0.003474 0.42054
22 2QS8 MET 0.01467 0.41908
23 3TL1 JRO 0.01506 0.41847
24 2QS8 MET 0.01239 0.41835
25 2QS8 MET 0.01239 0.41835
26 2QS8 MET 0.01239 0.41835
27 1TV5 N8E 0.0207 0.41685
28 3G58 988 0.01137 0.41594
29 3F8C HT1 0.01996 0.41591
30 3G58 988 0.0115 0.41571
31 3RWP ABQ 0.02337 0.41514
32 3RWP ABQ 0.02337 0.41514
33 2VWA PTY 0.02362 0.41443
34 3T2W BTN 0.01282 0.41337
35 3B6C SDN 0.01886 0.41337
36 2FDW D3G 0.01574 0.41307
37 2BP1 FLC 0.02488 0.41271
38 3QUG GIX 0.01606 0.41263
39 2ZPG TB0 0.01948 0.41253
40 2ZPG TB0 0.01948 0.41253
41 2Q8H TF4 0.01444 0.41248
42 3QUG GIX 0.0162 0.41243
43 3KO0 TFP 0.03345 0.4121
44 4J6C STR 0.02001 0.41203
45 2GJ3 FAD 0.004586 0.41178
46 4J6C STR 0.01688 0.41154
47 2FDW D3G 0.01704 0.41132
48 1W6O LAT 0.03744 0.41124
49 4N6H EJ4 0.02109 0.41084
50 2ALG DAO 0.02225 0.4108
51 2ALG DAO 0.02225 0.4108
52 4H4D 10E 0.01214 0.41055
53 2VWA PTY 0.02732 0.41049
54 4LRJ ANP 0.008756 0.40974
55 3FAL REA 0.01581 0.40885
56 1GZW GAL BGC 0.03895 0.4086
57 3F33 PFL 0.00743 0.40851
58 3CR3 ADP 0.00656 0.40839
59 2TOH HBI 0.02474 0.40833
60 3BY9 SIN 0.02518 0.40817
61 3KO0 TFP 0.04634 0.40713
62 2FDW D3G 0.02061 0.40712
63 2W8Q SIN 0.01598 0.40668
64 2W8Q SIN 0.01598 0.40668
65 1XMY ROL 0.02141 0.40627
66 3P1D MB3 0.02575 0.40603
67 2HJR CIT 0.02185 0.40582
68 2HJR CIT 0.02185 0.40582
69 2HJR CIT 0.02185 0.40582
70 3KO0 TFP 0.04958 0.40502
71 1XX4 BAM 0.01973 0.40497
72 1XX4 BAM 0.01973 0.40497
73 3UU7 2OH 0.02972 0.40482
74 4H4D 10E 0.01366 0.40436
75 1XM4 PIL 0.01642 0.4042
76 4LRJ ANP 0.0117 0.40394
77 3EWK FAD 0.00166 0.40367
78 3B12 FAH 0.03171 0.40302
79 2VC9 NOK 0.02101 0.40273
80 2WH8 II2 0.0178 0.40251
81 1XM4 PIL 0.01786 0.40242
82 3PLZ 470 0.008579 0.40222
83 4Q86 AMP 0.01825 0.40198
84 2H92 C5P 0.01839 0.40182
85 2OCI TYC 0.03337 0.40181
86 4Q86 AMP 0.01854 0.40165
87 3P9T TCL 0.02223 0.40151
88 2Z77 NCA 0.03191 0.4014
89 2Z77 NCA 0.03191 0.4014
90 4DS8 A8S 0.01585 0.40129
91 4OKW 198 0.009579 0.40114
92 2XIG CIT 0.04563 0.4006
93 4URG C2E 0.04083 0.40024
94 4R38 RBF 0.01016 0.40001
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