Receptor
PDB id Resolution Class Description Source Keywords
1NZL 1.9 Å EC: 2.7.1.112 CRYSTAL STRUCTURE OF SRC SH2 DOMAIN BOUND TO DOUBLY PHOSPHOR PEPTIDE PQPYEPYIPI ROUS SARCOMA VIRUS (STRAIN SCHMIDT-RUPORGANISM_TAXID: 11889 SH2 DOMAIN PHOSPHOTYROSINE TRANSFERASE
Ref.: STRUCTURAL AND THERMODYNAMIC BASIS FOR THE INTERACT THE SRC SH2 DOMAIN WITH THE ACTIVATED FORM OF THE P BETA-RECEPTOR J.MOL.BIOL. V. 328 655 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:2000;
A:2001;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
PG4 A:3000;
Invalid;
none;
submit data
194.226 C8 H18 O5 C(COC...
PRO GLN PTR GLU PTR ILE PRO ALA C:498;
Valid;
none;
Kd = 0.07 uM
1135 n/a [P+](...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1O44 1.7 Å EC: 2.7.1.112 CRYSTAL STRUCTURE OF SH2 IN COMPLEX WITH RU85052 HOMO SAPIENS SH2 DOMAIN FRAGMENT APPROACH SIGNALING PROTEIN
Ref.: REQUIREMENTS FOR SPECIFIC BINDING OF LOW AFFINITY INHIBITOR FRAGMENTS TO THE SH2 DOMAIN OF (PP60)SRC ARE IDENTICAL TO THOSE FOR HIGH AFFINITY BINDING OF FULL LENGTH INHIBITORS. J.MED.CHEM. V. 46 5184 2003
Members (36)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 1O48 ic50 = 450 nM 853 C33 H35 N3 O7 CC(=O)N[C@....
2 1O4N ic50 > 40 mM OXD C2 H2 O4 C(=O)(C(=O....
3 1O44 ic50 = 3 nM 852 C34 H35 N3 O9 CC(=O)N[C@....
4 1O4G ic50 > 5 mM I59 C11 H11 O4 P c1ccc2c(c1....
5 1SHD ic50 = 0.67 uM ACE PTR GLU GLU ILE GLU n/a n/a
6 1O4O ic50 = 3.5 mM HPS C6 H7 O4 P c1ccc(cc1)....
7 1A08 Kd = 2.4 uM ACE FTY GLU DIP n/a n/a
8 1A07 Kd = 0.4 uM ACE PTR GLU DIP n/a n/a
9 1A1B Kd = 0.4 uM ACE PTR GLU DIP n/a n/a
10 1NZV Kd = 0.4 uM PRO GLN PTR ILE PTR VAL PRO ALA n/a n/a
11 1O4L ic50 > 40 mM CIT C6 H8 O7 C(C(=O)O)C....
12 1SHA - PTR VAL PRO MET LEU n/a n/a
13 1F1W - SER PTR VAL ASN VAL GLN ASN n/a n/a
14 1O4P ic50 = 2.5 mM 791 C9 H8 O4 c1ccc(cc1)....
15 1O49 ic50 = 437 nM 493 C32 H36 N3 O9 P CC(=O)N[C@....
16 1O47 ic50 = 4 nM 822 C31 H34 F2 N3 O6 P CC(=O)N[C@....
17 1A1A - ACE PTH GLU DIP n/a n/a
18 1SHB - PTR LEU ARG VAL ALA n/a n/a
19 1O4B ic50 = 2000 nM 876 C30 H35 N3 O9 P2 CC(=O)N[C@....
20 1IS0 Kd = 0.1 uM AY0 GLU GLU ILE n/a n/a
21 1A1E Kd = 1 uM ACE PTR GLU DIY n/a n/a
22 4F5B - PTR C9 H12 N O6 P c1cc(ccc1C....
23 1O4J ic50 = 4.4 mM IS2 C9 H12 N O4 P CCc1ccc(cc....
24 1BKM - 1C5 C26 H39 N4 O10 P CC(=O)N[C@....
25 1O4Q ic50 = 3.2 mM 256 C8 H8 O5 S c1ccc(cc1)....
26 1SKJ ic50 = 7 uM UR2 C25 H38 N3 O10 P CN(CCCC1CC....
27 1A1C Kd = 0.4 uM ACE PTR GLU DIX n/a n/a
28 1O4H ic50 = 3.6 mM 772 C10 H7 N2 O4 P c1cc2ccc(n....
29 1P13 - CYS ASP PTR ALA ASN PHE LYS n/a n/a
30 1KC2 Kd = 0.21 uM PRO GLN PTR GLU GLU ILE PRO ILE n/a n/a
31 1O4R ic50 = 3.9 mM 787 C7 H10 O6 P2 c1ccc(cc1)....
32 1O46 ic50 = 10 nM 903 C35 H36 F N3 O9 CC(=O)N[C@....
33 1NZL Kd = 0.07 uM PRO GLN PTR GLU PTR ILE PRO ALA n/a n/a
34 1O4M ic50 > 40 mM MLA C3 H4 O4 C(C(=O)O)C....
35 1O4F ic50 = 0.3 mM 790 C9 H12 N O4 P c1cc2c(c(c....
36 1O42 ic50 = 9 nM 843 C30 H34 N3 O7 P CC(=O)N[C@....
70% Homology Family (41)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 families.
1 1O48 ic50 = 450 nM 853 C33 H35 N3 O7 CC(=O)N[C@....
2 1O4N ic50 > 40 mM OXD C2 H2 O4 C(=O)(C(=O....
3 1O44 ic50 = 3 nM 852 C34 H35 N3 O9 CC(=O)N[C@....
4 1O4G ic50 > 5 mM I59 C11 H11 O4 P c1ccc2c(c1....
5 1SHD ic50 = 0.67 uM ACE PTR GLU GLU ILE GLU n/a n/a
6 1O4O ic50 = 3.5 mM HPS C6 H7 O4 P c1ccc(cc1)....
7 1A08 Kd = 2.4 uM ACE FTY GLU DIP n/a n/a
8 1A07 Kd = 0.4 uM ACE PTR GLU DIP n/a n/a
9 1A1B Kd = 0.4 uM ACE PTR GLU DIP n/a n/a
10 1NZV Kd = 0.4 uM PRO GLN PTR ILE PTR VAL PRO ALA n/a n/a
11 1O4L ic50 > 40 mM CIT C6 H8 O7 C(C(=O)O)C....
12 1SHA - PTR VAL PRO MET LEU n/a n/a
13 1F1W - SER PTR VAL ASN VAL GLN ASN n/a n/a
14 1O4P ic50 = 2.5 mM 791 C9 H8 O4 c1ccc(cc1)....
15 1O49 ic50 = 437 nM 493 C32 H36 N3 O9 P CC(=O)N[C@....
16 1O47 ic50 = 4 nM 822 C31 H34 F2 N3 O6 P CC(=O)N[C@....
17 1A1A - ACE PTH GLU DIP n/a n/a
18 1SHB - PTR LEU ARG VAL ALA n/a n/a
19 1O4B ic50 = 2000 nM 876 C30 H35 N3 O9 P2 CC(=O)N[C@....
20 1IS0 Kd = 0.1 uM AY0 GLU GLU ILE n/a n/a
21 1A1E Kd = 1 uM ACE PTR GLU DIY n/a n/a
22 4F5B - PTR C9 H12 N O6 P c1cc(ccc1C....
23 1O4J ic50 = 4.4 mM IS2 C9 H12 N O4 P CCc1ccc(cc....
24 1BKM - 1C5 C26 H39 N4 O10 P CC(=O)N[C@....
25 1O4Q ic50 = 3.2 mM 256 C8 H8 O5 S c1ccc(cc1)....
26 1SKJ ic50 = 7 uM UR2 C25 H38 N3 O10 P CN(CCCC1CC....
27 1A1C Kd = 0.4 uM ACE PTR GLU DIX n/a n/a
28 1O4H ic50 = 3.6 mM 772 C10 H7 N2 O4 P c1cc2ccc(n....
29 1P13 - CYS ASP PTR ALA ASN PHE LYS n/a n/a
30 1KC2 Kd = 0.21 uM PRO GLN PTR GLU GLU ILE PRO ILE n/a n/a
31 1O4R ic50 = 3.9 mM 787 C7 H10 O6 P2 c1ccc(cc1)....
32 1O46 ic50 = 10 nM 903 C35 H36 F N3 O9 CC(=O)N[C@....
33 1NZL Kd = 0.07 uM PRO GLN PTR GLU PTR ILE PRO ALA n/a n/a
34 1O4M ic50 > 40 mM MLA C3 H4 O4 C(C(=O)O)C....
35 1O4F ic50 = 0.3 mM 790 C9 H12 N O4 P c1cc2c(c(c....
36 1O42 ic50 = 9 nM 843 C30 H34 N3 O7 P CC(=O)N[C@....
37 1CWD - PRO GLU GLY ASP PM3 GLU GLU VAL LEU n/a n/a
38 1LKL Kd = 1540 nM ACE PTR GLU GLU GLY n/a n/a
39 1FBZ - CC1 C30 H41 N3 O10 P2 CC(=O)N[C@....
40 1IJR - CC0 C29 H38 N3 O10 P C[C@@H](c1....
41 1CWE - ACE GLN PM3 GLU GLU ILE PRO n/a n/a
50% Homology Family (77)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 171 families.
1 3S9K - CIT C6 H8 O7 C(C(=O)O)C....
2 3IMJ Ka = 2100000 M^-1 AYI C22 H32 N5 O9 P CC[C@H](C)....
3 3C7I Ka = 440000 M^-1 TVN C21 H32 N5 O9 P CC(C)[C@@H....
4 3S8O Ka = 6960000 M^-1 ACE PTR 02K ASN NH2 n/a n/a
5 3IN8 Ka = 400000 M^-1 FYI C22 H34 N5 O9 P CC[C@H](C)....
6 1BMB ic50 = 0.7 uM LYS PRO PHE PTR VAL ASN VAL GLU PHE n/a n/a
7 3KFJ Ka = 300000 M^-1 YEN C21 H30 N5 O11 P CNC(=O)C[C....
8 1FYR ic50 = 2.4 uM ACE PTR VAL ASN VAL n/a n/a
9 3S8L Ka = 430000 M^-1 ACE PTR 192 ASN NH2 n/a n/a
10 3IN7 Ka = 1200000 M^-1 AYQ C21 H29 N6 O10 P CNC(=O)[C@....
11 4P9V Kd = 0.154 uM PHQ PTR 02K ASN NH2 n/a n/a
12 3OVE Ka = 3700000 M^-1 ACT PTR 03E ASN NH2 n/a n/a
13 1BM2 ic50 = 0.11 uM ACE SLZ PTR VAL ASN VAL PRO n/a n/a
14 4P9Z Kd = 87.7 nM NMI PTR 02K ASN NH2 n/a n/a
15 3OV1 Ka = 160000 M^-1 ACT PTR 1AC ASN NH2 n/a n/a
16 2HUW Ka = 1000000 M^-1 YVN C21 H30 N5 O9 P CC(C)[C@@H....
17 3N8M Ka = 6500000 M^-1 6NA PTR VAL ASN VAL 9PR n/a n/a
18 3S8N Ka = 1610000 M^-1 ACE PTR AC5 ASN NH2 n/a n/a
19 3IMD Ka = 560000 M^-1 FYQ C21 H31 N6 O10 P CNC(=O)C[C....
20 3N84 - PTR VAL ASN VAL PRO 011 n/a n/a
21 1O4N ic50 > 40 mM OXD C2 H2 O4 C(=O)(C(=O....
22 1O44 ic50 = 3 nM 852 C34 H35 N3 O9 CC(=O)N[C@....
23 1O4G ic50 > 5 mM I59 C11 H11 O4 P c1ccc2c(c1....
24 1SHD ic50 = 0.67 uM ACE PTR GLU GLU ILE GLU n/a n/a
25 1O4O ic50 = 3.5 mM HPS C6 H7 O4 P c1ccc(cc1)....
26 1A08 Kd = 2.4 uM ACE FTY GLU DIP n/a n/a
27 1A07 Kd = 0.4 uM ACE PTR GLU DIP n/a n/a
28 1A1B Kd = 0.4 uM ACE PTR GLU DIP n/a n/a
29 1NZV Kd = 0.4 uM PRO GLN PTR ILE PTR VAL PRO ALA n/a n/a
30 1O4L ic50 > 40 mM CIT C6 H8 O7 C(C(=O)O)C....
31 1SHA - PTR VAL PRO MET LEU n/a n/a
32 1F1W - SER PTR VAL ASN VAL GLN ASN n/a n/a
33 1O4P ic50 = 2.5 mM 791 C9 H8 O4 c1ccc(cc1)....
34 1O49 ic50 = 437 nM 493 C32 H36 N3 O9 P CC(=O)N[C@....
35 1O47 ic50 = 4 nM 822 C31 H34 F2 N3 O6 P CC(=O)N[C@....
36 1A1A - ACE PTH GLU DIP n/a n/a
37 1SHB - PTR LEU ARG VAL ALA n/a n/a
38 1O4B ic50 = 2000 nM 876 C30 H35 N3 O9 P2 CC(=O)N[C@....
39 1IS0 Kd = 0.1 uM AY0 GLU GLU ILE n/a n/a
40 1A1E Kd = 1 uM ACE PTR GLU DIY n/a n/a
41 4F5B - PTR C9 H12 N O6 P c1cc(ccc1C....
42 1BKM - 1C5 C26 H39 N4 O10 P CC(=O)N[C@....
43 1O4Q ic50 = 3.2 mM 256 C8 H8 O5 S c1ccc(cc1)....
44 1SKJ ic50 = 7 uM UR2 C25 H38 N3 O10 P CN(CCCC1CC....
45 1A1C Kd = 0.4 uM ACE PTR GLU DIX n/a n/a
46 1O4H ic50 = 3.6 mM 772 C10 H7 N2 O4 P c1cc2ccc(n....
47 1P13 - CYS ASP PTR ALA ASN PHE LYS n/a n/a
48 1KC2 Kd = 0.21 uM PRO GLN PTR GLU GLU ILE PRO ILE n/a n/a
49 1O4R ic50 = 3.9 mM 787 C7 H10 O6 P2 c1ccc(cc1)....
50 1O46 ic50 = 10 nM 903 C35 H36 F N3 O9 CC(=O)N[C@....
51 1NZL Kd = 0.07 uM PRO GLN PTR GLU PTR ILE PRO ALA n/a n/a
52 1O4M ic50 > 40 mM MLA C3 H4 O4 C(C(=O)O)C....
53 1O4F ic50 = 0.3 mM 790 C9 H12 N O4 P c1cc2c(c(c....
54 1O42 ic50 = 9 nM 843 C30 H34 N3 O7 P CC(=O)N[C@....
55 3MXY Kd = 384 nM GLN ASN GLY PTR VAL ASN PRO THR TYR n/a n/a
56 1JYQ Kd = 2.5 nM MAZ PTR PTM ASN n/a n/a
57 3WA4 - SER ASP PTR MET ASN MET THR n/a n/a
58 3MXC Kd = 286 nM GLN ASN GLY PTR GLU ASN PRO THR TYR n/a n/a
59 3N7Y Ka = 10000000 M^-1 PTR VAL ASN VAL 011 n/a n/a
60 2AOB - S1S C41 H46 N4 O10 c1ccc2c(c1....
61 1JYR Kd = 18 nM ALA PRO SER PTR VAL ASN VAL GLN ASN n/a n/a
62 1ZFP ic50 = 26 nM BE2 GLU PTR ILE ASN GLN NH2 n/a n/a
63 2AOA - S1S C41 H46 N4 O10 c1ccc2c(c1....
64 1TZE ic50 = 148 nM LYS PRO PHE PTR VAL ASN VAL NH2 n/a n/a
65 1LKK Kd = 140 nM ACE PTR GLU GLU ILE ACE n/a n/a
66 1BHF Ki = 42 uM ACE 1PA GLU GLU ILE n/a n/a
67 1CWD - PRO GLU GLY ASP PM3 GLU GLU VAL LEU n/a n/a
68 1LKL Kd = 1540 nM ACE PTR GLU GLU GLY n/a n/a
69 1FBZ - CC1 C30 H41 N3 O10 P2 CC(=O)N[C@....
70 1IJR - CC0 C29 H38 N3 O10 P C[C@@H](c1....
71 1CWE - ACE GLN PM3 GLU GLU ILE PRO n/a n/a
72 5GJI - SER ASP PTR MET ASN MET THR PRO n/a n/a
73 5GJH - SER ASP PTR MET ASN MET THR PRO n/a n/a
74 1LCK - GLU GLY GLN PTR GLN PRO GLN PRO ALA n/a n/a
75 1R1S - ACE PRO ASP PTR GLU ASN LEU n/a n/a
76 1R1P - ACE ASP ASP PTR VAL ASN VAL n/a n/a
77 1R1Q - ACE ARG GLU PTR VAL ASN VAL n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: PRO GLN PTR GLU PTR ILE PRO ALA; Similar ligands found: 60
No: Ligand ECFP6 Tc MDL keys Tc
1 PRO GLN PTR GLU PTR ILE PRO ALA 1 1
2 PRO GLN PTR GLU GLU ILE PRO ILE 0.880952 0.970588
3 PRO GLN PTR ILE PTR VAL PRO ALA 0.80916 0.985507
4 GLU GLY GLN PTR GLN PRO GLN PRO ALA 0.581081 0.913043
5 ASP PHE GLU GLU ILE PRO GLY GLU PTR 0.537037 0.957143
6 GLN ASN GLY PTR GLU ASN PRO THR TYR 0.526316 0.849315
7 ACE GLN PM3 GLU GLU ILE PRO 0.514085 0.897059
8 ALA PRO SER PTR VAL ASN VAL GLN ASN 0.509677 0.818182
9 ASP PHE GLU GLU ILE PRO GLU GLU TYS 0.509554 0.868421
10 PHE GLU ALA ILE PRO ALA GLU TYR LEU 0.509554 0.828571
11 LYS PRO PHE PTR VAL ASN VAL GLU PHE 0.49697 0.916667
12 GLU VAL PTR GLU SER PRO 0.486301 0.837838
13 ASP PHE GLU GLU ILE PRO GLY GLU TYS LEU 0.481928 0.846154
14 SER PRO THR SER PRO SEP TYR SER PRO PRO 0.468354 0.810811
15 ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU 0.467836 0.846154
16 TRP GLU TYR ILE PRO ASN VAL 0.467066 0.8
17 ASN ARG PRO VAL TYR ILE PRO PRO PRO PRO 0.463576 0.8
18 PHE SER ALA PTR PRO SER GLU GLU ASP 0.463415 0.851351
19 PRO MET GLN SER TPO PRO LEU 0.462025 0.759494
20 PTR VAL PRO MET LEU 0.46 0.849315
21 LYS LEU PRO ALA GLN PHE TYR ILE LEU 0.45509 0.857143
22 ACE TYR PRO ILE GLN GLU THR 0.451613 0.802817
23 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 0.449102 0.857143
24 ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU 0.447059 0.819444
25 SER ILE TYR PHE TPO PRO GLU LEU TYR ASP 0.446328 0.88
26 PRO GLU PRO THR ALA PRO PRO GLU GLU 0.444444 0.712329
27 SER ASP PTR MET ASN MET THR PRO 0.440994 0.810127
28 PRO GLU ALA THR ALA PRO PRO GLU GLU 0.440789 0.712329
29 LYS PRO PHE PTR VAL ASN VAL NH2 0.439024 0.902778
30 ACE LEU TYR ALA SER SER ASN PRO ALA PTR 0.433735 0.857143
31 GLN ASN GLY PTR VAL ASN PRO THR TYR 0.432099 0.878378
32 PRO ARG GLY TYR PRO GLY GLN VAL 0.43125 0.777778
33 LYS PRO SEP GLN GLU LEU 0.430556 0.794521
34 THR PRO TYR ASP ILE ASN GLN MET LEU 0.430233 0.74359
35 ASN TRP SER HIS PRO GLN PHE GLU LYS 0.428571 0.732394
36 LEU THR GLU PTR VAL ALA THR ARG 0.426471 0.657534
37 PRO THR SER SER GLU GLN ILE 0.425532 0.635135
38 6NA PTR VAL ASN VAL 9PR 0.423077 0.866667
39 ARG ILE PRO SER TYR ARG TYR ARG TYR 0.420732 0.759494
40 GLY TYR GLN ASP TYR GLU PRO GLU ALA 0.42 0.757143
41 ALA ILE ALA TYR PHE ILE PRO ASP GLN ALA 0.417178 0.828571
42 ACE PRO ASP PTR GLU ASN LEU 0.416667 0.864865
43 ILE THR ASP GLN VAL PRO PHE SER VAL 0.416667 0.733333
44 ARG ILE ILE PRO ARG HIS LEU GLN LEU 0.416185 0.727273
45 ARG VAL ILE PTR PHE VAL PRO LEU ASN ARG 0.414474 0.927536
46 ACE PTR GLU GLU ILE ACE 0.414286 0.73913
47 LEU PRO PRO GLU GLU ARG LEU ILE 0.412903 0.72
48 ARG LEU TYR GLN ASN PRO THR THR TYR ILE 0.412429 0.7625
49 PHE ASN PHE PRO GLN ILE THR 0.411392 0.780822
50 LYS GLN GLU PRO GLN GLU ILE ASP PHE 0.410714 0.782609
51 LYS LEU TYR GLN ASN PRO THR THR TYR ILE 0.410405 0.810811
52 PRO PRO THR LEU HIS GLU LEU TYR ASP LEU 0.40884 0.763158
53 PHE GLN PRO GLN ASN GLY GLN PHE ILE 0.408537 0.777778
54 PHE TYR ALA PRO GLU PRO ILE THR SER LEU 0.408046 0.789474
55 ILE MET ASP GLN VAL PRO PHE SER VAL 0.406977 0.683544
56 TRP ASP ILE PRO PHE 0.401408 0.73913
57 TRP MET ASP PHE ASP ASP ASP ILE PRO PHE 0.401408 0.73913
58 PRO THR SEP PRO SER TYR 0.401235 0.810811
59 LEU PRO PHE GLU ARG ALA THR ILE MET 0.401099 0.674699
60 LEU ASP GLU PTR VAL ALA THR ARG 0.4 0.685714
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1O44; Ligand: 852; Similar sites found: 48
This union binding pocket(no: 1) in the query (biounit: 1o44.bio1) has 42 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4RHS SIA SIA GAL 0.0008067 0.50491 None
2 1BHX ASP PHE GLU GLU ILE 0.003427 0.45919 None
3 2G30 ALA ALA PHE 0.006554 0.45632 None
4 3X01 AMP 0.00983 0.44871 None
5 1UPR 4IP 0.02216 0.43544 None
6 3QH2 3NM 0.01933 0.42853 None
7 4CQK PIO 0.03479 0.41639 None
8 4NS0 PIO 0.03033 0.41616 None
9 4MTI 2DX 0.03705 0.41302 None
10 3EFS BTN 0.01425 0.40956 None
11 1OPB RET 0.017 0.40906 None
12 1FHX 4IP 0.04481 0.40845 None
13 4DSU BZI 0.00004552 0.58166 1.85185
14 2XG5 EC5 0.0005185 0.52077 2.77778
15 2XG5 EC2 0.0005185 0.52077 2.77778
16 1W2D ADP 0.0259 0.41362 2.77778
17 3BY9 SIN 0.04945 0.40789 2.77778
18 2HBL AMP 0.02024 0.42717 3.7037
19 4XBA GMP 0.02654 0.40946 3.7037
20 4XBA 5GP 0.02742 0.40536 3.7037
21 3ZJX BOG 0.01679 0.43412 4.62963
22 4KBA 1QM 0.0004213 0.51227 5.55556
23 5D9G GLU ASN LEU TYR PHE GLN 0.005741 0.45227 5.55556
24 1QKQ MAN 0.01974 0.43112 5.55556
25 4DS0 A2G GAL NAG FUC 0.01743 0.41541 5.55556
26 5LKC FUC GLA A2G 0.03533 0.41199 5.55556
27 5EW9 5VC 0.01818 0.4 5.55556
28 4XG0 CIT 0.03252 0.42628 6.48148
29 4IAW LIZ 0.01785 0.42205 6.48148
30 3PA8 621 0.02993 0.41812 6.48148
31 1GPM AMP 0.03572 0.40876 6.48148
32 2WBV SIA 0.03145 0.40337 6.48148
33 4XLI 1N1 0.01381 0.41669 7.40741
34 3JQ3 ADP 0.02335 0.41597 7.40741
35 5C5T AKG 0.04247 0.40592 7.40741
36 1I1E DM2 0.01564 0.43356 8.33333
37 1SBR VIB 0.005866 0.45675 9.25926
38 2CYB TYR 0.04333 0.4111 9.25926
39 2NGR AF3 0.01254 0.43879 10.1852
40 2VDF OCT 0.03086 0.42259 10.1852
41 1UNQ 4IP 0.01097 0.44461 11.1111
42 2PZI AXX 0.03842 0.40123 12.037
43 5MRH Q9Z 0.01774 0.42624 12.963
44 4YVN EBS 0.04735 0.40868 12.963
45 5BVE 4VG 0.003939 0.4076 17.5926
46 3SJK LYS PRO VAL LEU ARG THR ALA 0.02436 0.42221 18.5185
47 5F7Y GLC GAL NAG GAL FUC A2G 0.03181 0.40544 19.4444
48 3GXW SIN 0.000358 0.4615 41.7476
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