Receptor
PDB id Resolution Class Description Source Keywords
3QFJ 2.29 Å NON-ENZYME: IMMUNE THE COMPLEX BETWEEN TCR A6 AND HUMAN CLASS I MHC HLA-A2 WITH MODIFIED TAX (Y5F) PEPTIDE HOMO SAPIENS TAX PEPTIDE NONAPEPTIDE MHC CLASS I HLA-A2 TCR A6 CROSSREACTIVITY Y5F MUTATION IMMUNE SYSTEM
Ref.: DISPARATE DEGREES OF HYPERVARIABLE LOOP FLEXIBILITY T-CELL RECEPTOR CROSS-REACTIVITY, SPECIFICITY, AND MECHANISM. J.MOL.BIOL. V. 414 385 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GOL A:276;
A:277;
B:100;
B:101;
B:102;
C:10;
D:207;
E:247;
E:248;
E:249;
E:250;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
LEU LEU PHE GLY PHE PRO VAL TYR VAL C:1;
Valid;
none;
submit data
1054.3 n/a O=C([...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3QFJ 2.29 Å NON-ENZYME: IMMUNE THE COMPLEX BETWEEN TCR A6 AND HUMAN CLASS I MHC HLA-A2 WITH MODIFIED TAX (Y5F) PEPTIDE HOMO SAPIENS TAX PEPTIDE NONAPEPTIDE MHC CLASS I HLA-A2 TCR A6 CROSSREACTIVITY Y5F MUTATION IMMUNE SYSTEM
Ref.: DISPARATE DEGREES OF HYPERVARIABLE LOOP FLEXIBILITY T-CELL RECEPTOR CROSS-REACTIVITY, SPECIFICITY, AND MECHANISM. J.MOL.BIOL. V. 414 385 2011
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 199 families.
1 3QFJ - LEU LEU PHE GLY PHE PRO VAL TYR VAL n/a n/a
70% Homology Family (33)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 65 families.
1 4JFF Kd = 600 pM GLU LEU ALA GLY ILE GLY ILE LEU THR VAL n/a n/a
2 4JFD Kd = 36 uM GLU LEU ALA ALA ILE GLY ILE LEU THR VAL n/a n/a
3 2F53 - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
4 2P5E - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
5 2BNQ Kd = 5 uM SER LEU LEU MET TRP ILE THR GLN VAL n/a n/a
6 2BNR Kd = 13.3 uM SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
7 2PYE - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
8 2P5W - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
9 5HHM - GLY ILE LEU GLY LEU VAL PHE THR LEU n/a n/a
10 2VLK - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
11 2VLJ - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
12 1OGA - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
13 2VLR - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
14 5ISZ Kd = 27 nM GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
15 3QFJ - LEU LEU PHE GLY PHE PRO VAL TYR VAL n/a n/a
16 5IVX Kd ~ 0.54 uM ARG GLY PRO GLY ARG ALA PHE VAL THR ILE n/a n/a
17 5EU6 - TYR LEU GLU PRO GLY PRO VAL THR VAL n/a n/a
18 1BD2 - LEU LEU PHE GLY TYR PRO VAL TYR VAL n/a n/a
19 5JHD Kd = 37 nM GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
20 2UWE - ALA LEU TRP GLY PHE PHE PRO VAL LEU n/a n/a
21 3QDJ - ALA ALA GLY ILE GLY ILE LEU THR VAL n/a n/a
22 5C09 - TYR LEU GLY GLY PRO ASP PHE PRO THR ILE n/a n/a
23 5C0A - MET VAL TRP GLY PRO ASP PRO LEU TYR VAL n/a n/a
24 5C08 - ARG GLN TRP GLY PRO ASP PRO ALA ALA VAL n/a n/a
25 5C0B - ARG GLN PHE GLY PRO ASP PHE PRO THR ILE n/a n/a
26 5C07 - TYR GLN PHE GLY PRO ASP PHE PRO ILE ALA n/a n/a
27 5C0C - ARG GLN PHE GLY PRO ASP TRP ILE VAL ALA n/a n/a
28 5BS0 Kd = 76.7 nM GLU SER ASP PRO ILE VAL ALA GLN TYR n/a n/a
29 1MI5 Kd ~ 10 uM PHE LEU ARG GLY ARG ALA TYR GLY LEU n/a n/a
30 3VXS - ARG TYR PRO LEU THR LEU GLY TRP CYS PHE n/a n/a
31 3VXR - ARG TYR PRO LEU THR PHE GLY TRP CYS PHE n/a n/a
32 4G9F - LYS ARG TRP ILE ILE MET GLY LEU ASN LYS n/a n/a
33 4G8G - LYS ARG TRP ILE ILE LEU GLY LEU ASN LYS n/a n/a
50% Homology Family (41)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 43 families.
1 4JFF Kd = 600 pM GLU LEU ALA GLY ILE GLY ILE LEU THR VAL n/a n/a
2 4JFD Kd = 36 uM GLU LEU ALA ALA ILE GLY ILE LEU THR VAL n/a n/a
3 2F53 - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
4 2P5E - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
5 2BNQ Kd = 5 uM SER LEU LEU MET TRP ILE THR GLN VAL n/a n/a
6 2BNR Kd = 13.3 uM SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
7 2PYE - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
8 2P5W - SER LEU LEU MET TRP ILE THR GLN CYS n/a n/a
9 3VXM - ARG PHE PRO LEU THR PHE GLY TRP CYS PHE n/a n/a
10 5JZI - LYS LEU VAL ALA LEU GLY ILE ASN ALA VAL n/a n/a
11 5HHM - GLY ILE LEU GLY LEU VAL PHE THR LEU n/a n/a
12 2VLK - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
13 2VLJ - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
14 1OGA - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
15 2VLR - GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
16 5ISZ Kd = 27 nM GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
17 3QFJ - LEU LEU PHE GLY PHE PRO VAL TYR VAL n/a n/a
18 5IVX Kd ~ 0.54 uM ARG GLY PRO GLY ARG ALA PHE VAL THR ILE n/a n/a
19 5EU6 - TYR LEU GLU PRO GLY PRO VAL THR VAL n/a n/a
20 1BD2 - LEU LEU PHE GLY TYR PRO VAL TYR VAL n/a n/a
21 5JHD Kd = 37 nM GLY ILE LEU GLY PHE VAL PHE THR LEU n/a n/a
22 4NQD - 2LJ C12 H18 N4 O7 CC(=O)/C=N....
23 4LCW - 1VY C12 H16 N4 O7 CC1=C(N(C2....
24 4L4V Kd = 1.65 uM 1VY C12 H16 N4 O7 CC1=C(N(C2....
25 2JCC - ALA LEU TRP GLY PHE PHE PRO VAL LEU n/a n/a
26 2UWE - ALA LEU TRP GLY PHE PHE PRO VAL LEU n/a n/a
27 1LP9 - ALA LEU TRP GLY PHE PHE PRO VAL LEU n/a n/a
28 3QDJ - ALA ALA GLY ILE GLY ILE LEU THR VAL n/a n/a
29 5C09 - TYR LEU GLY GLY PRO ASP PHE PRO THR ILE n/a n/a
30 5C0A - MET VAL TRP GLY PRO ASP PRO LEU TYR VAL n/a n/a
31 5C08 - ARG GLN TRP GLY PRO ASP PRO ALA ALA VAL n/a n/a
32 5C0B - ARG GLN PHE GLY PRO ASP PHE PRO THR ILE n/a n/a
33 5C07 - TYR GLN PHE GLY PRO ASP PHE PRO ILE ALA n/a n/a
34 5C0C - ARG GLN PHE GLY PRO ASP TRP ILE VAL ALA n/a n/a
35 5BS0 Kd = 76.7 nM GLU SER ASP PRO ILE VAL ALA GLN TYR n/a n/a
36 1MI5 Kd ~ 10 uM PHE LEU ARG GLY ARG ALA TYR GLY LEU n/a n/a
37 3VXS - ARG TYR PRO LEU THR LEU GLY TRP CYS PHE n/a n/a
38 3VXR - ARG TYR PRO LEU THR PHE GLY TRP CYS PHE n/a n/a
39 1MWA - GLU GLN TYR LYS PHE TYR SER VAL n/a n/a
40 4G9F - LYS ARG TRP ILE ILE MET GLY LEU ASN LYS n/a n/a
41 4G8G - LYS ARG TRP ILE ILE LEU GLY LEU ASN LYS n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: LEU LEU PHE GLY PHE PRO VAL TYR VAL; Similar ligands found: 171
No: Ligand ECFP6 Tc MDL keys Tc
1 LEU LEU PHE GLY PHE PRO VAL TYR VAL 1 1
2 LEU LEU PHE GLY TYR PRO VAL TYR VAL 1 1
3 LEU PHE GLY TYR PRO VAL TYR VAL 0.940678 1
4 LEU LEU PHE GLY LYS PRO VAL TYR VAL 0.882812 0.983607
5 LEU LEU TYR GLY PHE VAL ASN TYR VAL 0.659091 0.734375
6 LEU TYR ALA SER PRO GLN LEU GLU GLY PHE 0.620915 0.9375
7 LEU LEU TYR GLY PHE VAL ASN TYR ILE 0.6 0.723077
8 ALA LEU TRP GLY PHE PHE PRO VAL LEU 0.598684 0.888889
9 PHE ALA PRO GLY PHE PHE PRO TYR LEU 0.597222 0.952381
10 GLU TYR LEU GLY LEU ASP VAL PRO VAL 0.589041 0.95082
11 TYR LEU LYS GLU PRO VAL HIS GLY VAL 0.583333 0.921875
12 ALA LEU TRP GLY PHE VAL PRO VAL LEU 0.564103 0.888889
13 ARG TYR PRO LEU THR PHE GLY TRP 0.562874 0.821918
14 PHE LEU PRO SER ASP PHE PHE PRO SER VAL 0.556338 0.863636
15 TYR LEU GLY GLY PRO ASP PHE PRO THR ILE 0.552795 0.909091
16 PHE ALA PRO GLY ASN TYR PRO ALA LEU 0.54902 0.895522
17 TYR LEU GLU PRO GLY PRO VAL THR VAL 0.546667 0.892308
18 ILE PRO ALA TYR GLY VAL LEU THR ILE 0.546053 0.90625
19 PHE TYR ALA PRO GLU PRO ILE THR SER LEU 0.534591 0.882353
20 TYR LEU GLU PRO ALA PRO VAL THR ALA 0.527027 0.863636
21 ARG PHE PRO LEU THR PHE GLY TRP 0.526946 0.794521
22 LYS PRO ILE VAL VAL LEU HIS GLY TYR 0.524691 0.907692
23 TYR LEU GLU PRO GLY PRO VAL THR ALA 0.522876 0.892308
24 MET VAL TRP GLY PRO ASP PRO LEU TYR VAL 0.520231 0.869565
25 PHE LEU ARG GLY ARG ALA TYR VAL LEU 0.519737 0.720588
26 TYR GLN PHE GLY PRO ASP PHE PRO ILE ALA 0.518293 0.907692
27 TYR LEU ALA PRO GLY PRO VAL THR ALA 0.516779 0.878788
28 LEU GLY TYR GLY PHE VAL ASN TYR ILE 0.513889 0.723077
29 LEU SER SER PRO VAL THR LYS SER PHE 0.513333 0.818182
30 PHE GLN PRO GLN ASN GLY GLN PHE ILE 0.513158 0.818182
31 HIS SER ILE THR TYR LEU LEU PRO VAL 0.506173 0.828571
32 ARG TYR PRO LEU THR PHE GLY TRP CYS PHE 0.502732 0.786667
33 VAL ORN LEU DPN PRO VAL ORN LEU DPN PRO 0.5 0.83871
34 PRO ARG GLY TYR PRO GLY GLN VAL 0.5 0.904762
35 ASP ARG VAL TYR ILE HIS PRO PHE 0.5 0.833333
36 TYR MET PHE PRO ASN ALA PRO TYR LEU 0.5 0.830986
37 ARG TYR PRO LEU THR LEU GLY TRP CYS PHE 0.497268 0.8
38 LEU ASN PHE PRO ILE SER PRO 0.496552 0.797101
39 ILE ARG TYR PRO LYS THR PHE GLY TRP 0.494382 0.797297
40 PHE GLU ALA ILE PRO ALA GLU TYR LEU 0.493671 0.967213
41 LEU TYR LEU VAL CYS GLY GLU ARG GLY PHE 0.493671 0.710145
42 ASN PHE ASP ASN PRO VAL TYR ARG LYS THR 0.491228 0.808219
43 DHI PRO PHE HIS LEU LEU VAL TYR 0.491018 0.90625
44 PHE ALA PRO GLY ASN TYI PRO ALA LEU 0.490683 0.833333
45 LEU TYR LEU VAL CYS GLY GLU ARG VAL 0.490196 0.681159
46 ARG PHE PRO LEU THR PHE GLY TRP CYS PHE 0.488889 0.773333
47 ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU 0.484848 0.952381
48 LYS LEU PRO ALA GLN PHE TYR ILE LEU 0.484663 0.936508
49 PHE LEU ARG GLY ARG ALA TYR GLY LEU 0.483221 0.720588
50 ASN ARG PRO VAL TYR ILE PRO ARG PRO PRO 0.480769 0.8
51 ILE LEU LYS GLU PRO VAL HIS GLY VAL 0.47561 0.815385
52 ARG SEP PRO VAL PHE SER 0.474684 0.662338
53 SER ILE TYR PHE TPO PRO GLU LEU TYR ASP 0.473988 0.821918
54 SER ASP ILE LEU PHE PRO ALA ASP SER 0.473684 0.818182
55 ARG MET PHE PRO ASN ALA PRO TYR LEU 0.473373 0.779221
56 ARG LEU TYR GLN ASN PRO THR THR TYR ILE 0.473373 0.797297
57 LYS LEU TYR GLN ASN PRO THR THR TYR ILE 0.472727 0.852941
58 LEU GLN ARG VAL LEU SEP ALA PRO PHE 0.46875 0.666667
59 ARG PRO MET THR TYR LYS GLY ALA LEU 0.468208 0.763158
60 ILE GLY PRO GLY ARG ALA PHE TYR THR ILE 0.468208 0.830986
61 SER SER PHE TYR PRO SEP ALA GLU GLY 0.467949 0.788732
62 ASN GLY TYR GLU ASN PRO THR TYR LYS 0.466258 0.850746
63 GLN LEU SER PRO PHE PRO PHE ASP LEU 0.464968 0.820895
64 LYS PRO ILE VAL GLN TYR ASP ASN PHE 0.464286 0.880597
65 ILE GLY PRO GLY ARG ALA PHE TYR ALA 0.463855 0.867647
66 SER SER TYR ARG ARG PRO VAL GLY ILE 0.463415 0.77027
67 PHE ALA PRO GLY ASN TYR PRO ALA TRP 0.462428 0.84058
68 GLY TYR GLN ASP TYR GLU PRO GLU ALA 0.462069 0.885246
69 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 0.460606 0.90625
70 GLN ASN TYR PRO ILE VAL GLN 0.460526 0.876923
71 VAL TYR ILE HIS PRO PHE 0.459627 0.876923
72 GLY TYR GLU ASN PRO THR TYR LYS PHE PHE 0.457831 0.863636
73 ARG ARG LEU PRO ILE PHE SER ARG LEU 0.45679 0.716216
74 ARG PRO MET THR PHE LYS GLY ALA LEU 0.456647 0.723684
75 PHE LEU SER TYR LYS 0.456522 0.75
76 ILE SER TYR GLY ASN ASP ALA LEU MET PRO 0.45614 0.805556
77 GLY ALA GLU VAL PHE TYR VAL ASP GLY ALA 0.455782 0.758065
78 GLY LEU LEU GLY SER PRO VAL ARG ALA 0.453947 0.742857
79 TYR GLY GLY PHE LEU 0.451852 0.8
80 ASN TYR THR PRO GLY PRO GLY THR ARG PHE 0.450867 0.794521
81 ASP PHE GLU GLU ILE PRO GLY GLU TYS LEU 0.449704 0.766234
82 ASP VAL GLN THR GLY ARG ARG PRO TYR GLU 0.449704 0.791667
83 SER SER LEU GLU ASN PHE ALA ALA TYR VAL 0.448718 0.686567
84 TYR PRO PHE PHE NH2 0.448529 0.883333
85 ALA ILE ALA TYR PHE ILE PRO ASP GLN ALA 0.446541 0.935484
86 LEU TYR LEU VAL CYS GLY GLU ARG GLY 0.44586 0.681159
87 ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU 0.445087 0.766234
88 MET LEU TRP GLY TYR LEU GLN TYR VAL 0.444444 0.791045
89 GLN ASN GLY PTR VAL ASN PRO THR TYR 0.44375 0.794521
90 ARG GLN PHE GLY PRO ASP PHE PRO THR ILE 0.443182 0.780822
91 ILE LEU GLY PRO PRO GLY SER VAL TYR 0.442424 0.865672
92 PHE ASN ARG PRO VAL 0.442177 0.742857
93 PHE ASN PHE PRO GLN ILE THR 0.441558 0.820895
94 ASN TYR THR PRO GLY PRO GLY ILE ARG PHE 0.440678 0.808219
95 LEU PRO PHE GLU LYS SER THR VAL MET 0.440476 0.785714
96 GLY ARG PRO ARG THR THR SER PHE ALA GLU 0.440476 0.726027
97 VAL PRO LEU ARG PRO MET THR TYR 0.439759 0.75
98 MET TYR TRP TYR PRO TYR 0.43949 0.835821
99 GLN VAL PRO LEU ARG PRO MET THR TYR LYS 0.438889 0.763158
100 TYR PRO ASN VAL ASN ILE HIS ASN PHE 0.438596 0.855072
101 GLY ALA GLU THR PHE TYR VAL ASP GLY ALA 0.437909 0.723077
102 GLY LEU LEU GLY SEP PRO VAL ARG ALA 0.4375 0.662338
103 GLU ALA ASP PRO THR GLY HIS SER TYR 0.436782 0.826087
104 ILE THR ASP GLN VAL PRO PHE SER VAL 0.436364 0.820895
105 LYS TYR TYR SER ILE ILE PRO HIS SER ILE 0.435583 0.828571
106 TYR TYR SER ILE ILE PRO HIS SER ILE 0.435583 0.828571
107 TRP GLU TYR ILE PRO ASN VAL 0.435294 0.867647
108 ARG PRO GLY ASN PHE LEU GLN SER SER PRO 0.434286 0.72973
109 TYR SEP PRO THR SEP PRO SER 0.432432 0.739726
110 VAL MET ALA PRO ARG THR LEU PHE LEU 0.431953 0.710526
111 PHE LEU TRP GLY PRO ARG ALA LEU VAL 0.431818 0.8
112 ALA ILE MET PRO ALA ARG PHE TYR PRO LYS 0.430939 0.783784
113 PHE PRO ARG PRO TRP LEU HIS GLY LEU 0.430939 0.777778
114 PHE PRO THR LYS ASP VAL ALA LEU 0.428571 0.830769
115 SER SER GLY LYS VAL PRO LEU SER 0.428571 0.787879
116 GLU THR PHE TYR VAL ASP GLY 0.428571 0.734375
117 ARG LEU TYR HIS SEP LEU PRO ALA 0.427746 0.7125
118 PHE ARG TYR LEU GLY 0.427586 0.731343
119 ARG TYR GLY PHE VAL ALA ASN PHE 0.426752 0.685714
120 LEU PRO PHE GLU ARG ALA THR VAL MET 0.426136 0.733333
121 PHE LEU ALA TYR LYS 0.425532 0.783333
122 TYR TYR SER ILE ALA PRO HIS SER ILE 0.42515 0.802817
123 ARG GLY TYR VAL TYR GLN GLY LEU 0.424837 0.731343
124 LYS PRO PHE PTR VAL ASN VAL NH2 0.424242 0.767123
125 ARG PRO GLY ASN PHE LEU GLN SER ARG PRO 0.423729 0.72
126 PHE SER ASP PRO TRP GLY GLY 0.420732 0.779412
127 ARG PRO GLY ASN PHE LEU GLN SER ARG LEU 0.420455 0.706667
128 PHE GLU ASP ASN PHE VAL PRO 0.42 0.846154
129 ASN ASP TRP LEU LEU PRO SER TYR 0.41954 0.857143
130 ACE LEU TYR ALA SER SER ASN PRO ALA PTR 0.419162 0.8
131 GLY LEU MET TRP LEU SER TYR PHE VAL 0.418182 0.742857
132 LYS THR PHE PRO PRO THR GLU PRO LYS 0.418182 0.815385
133 GLU PTR LEU GLY LEU ASP VAL PRO VAL 0.41791 0.819672
134 PHE LEU THR GLY ILE GLY ILE ILE THR VAL 0.417808 0.630769
135 ALA ASN SER ARG TYR PRO THR SER ILE ILE 0.417647 0.77027
136 PHE SER HIS PRO GLN ASN THR 0.417178 0.771429
137 SER LEU PHE HIS 22G THR PRO 0.417143 0.855072
138 GLY ILE LEU GLY PHE VAL PHE THR LEU 0.416107 0.6875
139 GLU PHE SER PRO 0.414815 0.793651
140 ARG ILE PRO SER TYR ARG TYR ARG TYR 0.414634 0.77027
141 TRP ASP ILE PRO PHE 0.414286 0.806452
142 TRP MET ASP PHE ASP ASP ASP ILE PRO PHE 0.414286 0.806452
143 GLU SER ASP PRO ILE VAL ALA GLN TYR 0.414201 0.865672
144 LYS PRO PHE PTR VAL ASN VAL GLU PHE 0.413793 0.780822
145 THR GLU ASN LEU TYR PHE GLN SER GLY THR 0.41358 0.731343
146 ARG VAL SER PRO SER THR SER TYR THR PRO 0.413333 0.846154
147 GLY ILE LEU GLY LEU VAL PHE THR LEU 0.413333 0.65625
148 LYS PRO VAL LEU ARG THR ALA 0.412903 0.732394
149 DVA DPR GLY DSN DGN DHI DTY DAS DSN 0.412791 0.828571
150 GLU GLY GLN PTR GLN PRO GLN PRO ALA 0.412121 0.771429
151 CYS VAL ASN GLY SER CYS PHE THR VAL 0.411765 0.602941
152 GLU GLU PRO THR VAL ILE LYS LYS TYR 0.410714 0.876923
153 LEU ASP GLU GLU THR GLY GLU PHE LEU 0.410596 0.6875
154 ASN LEU VAL PRO VAL VAL ALA THR VAL 0.410596 0.787879
155 LYS VAL LEU PHE LEU ASP GLY 0.409722 0.704918
156 GLU GLN TYR LYS PHE TYR SER VAL 0.409396 0.727273
157 ILE MET ASP GLN VAL PRO PHE SER VAL 0.409357 0.760563
158 GLN VAL PRO SER ASP PRO TYR ASN TYR 0.407407 0.838235
159 ARG GLY PRO GLY ARG ALA PHE VAL THR ILE 0.40678 0.753425
160 ASP ASP MET GLY PHE GLY LEU PHE ASP 0.405797 0.688525
161 ASP ASP ASP MET GLY PHE GLY LEU PHE ASP 0.405797 0.688525
162 ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA 0.405229 0.934426
163 ARG VAL ALA SER PRO THR SER GLY VAL 0.405063 0.722222
164 ARG PRO PRO GLY PHE SER PRO PHE ALA 0.404762 0.736111
165 SER SER GLY LYS VAL PRO LEU 0.40411 0.8
166 GLY SER ASP PRO PHE LYS 0.402685 0.757576
167 ALA TRP ARG HIS PRO GLN PHE GLY GLY 0.402174 0.746479
168 ARG GLY TYR LEU TYR GLN GLY LEU 0.401316 0.731343
169 ASP PHE GLU GLU ILE PRO GLY GLU PTR 0.40113 0.816901
170 GLU ASN LEU TYR PHE GLN 0.4 0.703125
171 ASP ASP LEU TYR GLY 0.4 0.725806
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3QFJ; Ligand: LEU LEU PHE GLY PHE PRO VAL TYR VAL; Similar sites found: 45
This union binding pocket(no: 1) in the query (biounit: 3qfj.bio1) has 43 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4V3I ASP LEU THR ARG PRO 0.03013 0.42653 5
2 1M2Z BOG 0.03204 0.42127 5.5
3 1JGS SAL 0.02589 0.44501 5.7971
4 4RW3 PLM 0.0381 0.40763 5.81818
5 2BYC FMN 0.03821 0.40578 5.83942
6 2WH8 II2 0.03251 0.41665 6
7 3B6C SDN 0.01468 0.4398 6.41026
8 1NF8 BOG 0.001439 0.50601 7
9 4UCC ZKW 0.02649 0.44156 7
10 3U3U EAH 0.01538 0.41272 7
11 3W54 RNB 0.02506 0.41187 8
12 3IPQ 965 0.006505 0.40263 8
13 4PJT 2YQ 0.01167 0.40172 8
14 2PEH LYS ARG LYS SER ARG TRP ASP GLU THR PRO 0.03656 0.41021 8.57143
15 2VWA PTY 0.01365 0.44435 8.91089
16 2WDA L42 0.02634 0.42763 9
17 5V4R MGT 0.01269 0.4457 9.25926
18 1AUA BOG 0.03316 0.42014 9.5
19 2VDY HCY 0.0115 0.44767 10
20 4URN NOV 0.03215 0.42359 10
21 3GXO MQA 0.03887 0.41242 10
22 1SDW IYT 0.03532 0.40756 10.1818
23 3AQT RCO 0.02844 0.4277 10.9091
24 4MGA 27L 0.01171 0.44773 11
25 1XMY ROL 0.01916 0.4291 11
26 3G58 988 0.01923 0.425 11
27 5K53 STE 0.01308 0.41301 11
28 3OKI OKI 0.01473 0.41062 12
29 3KP6 SAL 0.04213 0.4273 12.5828
30 1XVB 3BR 0.0364 0.41031 13.5294
31 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.00895 0.45914 14
32 4IBF 1D5 0.02554 0.41146 15
33 1TV5 N8E 0.001214 0.49937 16
34 2CB8 MYA 0.01917 0.4364 16.092
35 2IYG FMN 0.04896 0.40015 16.129
36 3TDC 0EU 0.03389 0.4181 17.0909
37 4DK7 0KS 0.01304 0.41612 18
38 4M52 M52 0.02878 0.40264 19
39 3JUQ AJD 0.01281 0.40772 20.5405
40 3JUQ AKD 0.0153 0.40166 20.5405
41 1ELW GLY PRO THR ILE GLU GLU VAL ASP 0.01648 0.4247 21
42 2QCX PF1 0.02665 0.42852 22
43 4OKD GLC GLC GLC 0.04869 0.41375 24.898
44 5LX9 OLB 0.02258 0.41417 25
45 5OCA 9QZ 0.004595 0.45549 45.6221
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