## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
O |
138 |
35 |
4952 |
◊ |
N |
x,y,z |
1_555 |
129 |
35 |
4987 |
1259.0 |
-9.6 |
0.272 |
18 |
4 |
0 |
1.000 |
2 |
|
R |
136 |
35 |
4916 |
◊ |
Q |
x,y,z |
1_555 |
127 |
34 |
4953 |
1243.1 |
-11.2 |
0.207 |
20 |
3 |
0 |
1.000 |
3 |
|
Q |
136 |
35 |
4953 |
◊ |
P |
x,y,z |
1_555 |
123 |
33 |
4924 |
1237.3 |
-10.6 |
0.235 |
21 |
4 |
0 |
1.000 |
4 |
|
N |
138 |
35 |
4987 |
◊ |
M |
x,y,z |
1_555 |
130 |
34 |
4931 |
1230.7 |
-10.1 |
0.266 |
20 |
4 |
0 |
1.000 |
5 |
|
V |
133 |
34 |
4959 |
◊ |
U |
x,y,z |
1_555 |
124 |
34 |
4904 |
1229.6 |
-9.3 |
0.275 |
20 |
4 |
0 |
1.000 |
6 |
|
V |
124 |
33 |
4959 |
◊ |
L |
x,y,z |
1_555 |
131 |
35 |
4934 |
1217.2 |
-9.9 |
0.251 |
21 |
3 |
0 |
1.000 |
7 |
|
U |
135 |
35 |
4904 |
◊ |
T |
x,y,z |
1_555 |
127 |
33 |
4935 |
1214.9 |
-10.8 |
0.221 |
19 |
4 |
0 |
1.000 |
8 |
|
T |
130 |
32 |
4935 |
◊ |
S |
x,y,z |
1_555 |
120 |
33 |
4912 |
1213.8 |
-10.2 |
0.230 |
20 |
4 |
0 |
1.000 |
9 |
|
P |
133 |
35 |
4924 |
◊ |
O |
x,y,z |
1_555 |
125 |
33 |
4952 |
1209.4 |
-12.4 |
0.178 |
17 |
3 |
0 |
1.000 |
10 |
|
M |
137 |
35 |
4931 |
◊ |
L |
x,y,z |
1_555 |
123 |
34 |
4934 |
1204.2 |
-11.1 |
0.223 |
17 |
4 |
0 |
1.000 |
11 |
|
S |
132 |
35 |
4912 |
◊ |
R |
x,y,z |
1_555 |
121 |
33 |
4916 |
1199.6 |
-10.7 |
0.227 |
20 |
4 |
0 |
1.000 |
12 |
|
K |
119 |
30 |
4755 |
◊ |
A |
x,y,z |
1_555 |
124 |
32 |
4895 |
1181.4 |
-9.1 |
0.199 |
17 |
5 |
0 |
1.000 |
13 |
|
I |
118 |
30 |
4884 |
◊ |
H |
x,y,z |
1_555 |
122 |
30 |
4791 |
1176.0 |
-8.9 |
0.222 |
16 |
6 |
0 |
1.000 |
14 |
|
C |
118 |
31 |
4897 |
◊ |
B |
x,y,z |
1_555 |
119 |
29 |
4847 |
1173.6 |
-10.0 |
0.170 |
15 |
3 |
0 |
1.000 |
15 |
|
G |
121 |
33 |
4738 |
◊ |
F |
x,y,z |
1_555 |
125 |
31 |
4929 |
1161.1 |
-9.1 |
0.247 |
17 |
8 |
0 |
1.000 |
16 |
|
E |
115 |
31 |
4797 |
◊ |
D |
x,y,z |
1_555 |
122 |
32 |
4804 |
1159.5 |
-8.8 |
0.266 |
18 |
6 |
0 |
1.000 |
17 |
|
J |
117 |
31 |
4719 |
◊ |
I |
x,y,z |
1_555 |
121 |
31 |
4884 |
1153.1 |
-10.2 |
0.172 |
15 |
4 |
0 |
1.000 |
18 |
|
D |
116 |
31 |
4804 |
◊ |
C |
x,y,z |
1_555 |
122 |
30 |
4897 |
1147.3 |
-9.6 |
0.196 |
17 |
5 |
0 |
1.000 |
19 |
|
B |
114 |
30 |
4847 |
◊ |
A |
x,y,z |
1_555 |
119 |
30 |
4895 |
1141.4 |
-9.6 |
0.187 |
16 |
4 |
0 |
1.000 |
20 |
|
K |
115 |
31 |
4755 |
◊ |
J |
x,y,z |
1_555 |
115 |
29 |
4719 |
1140.2 |
-9.7 |
0.167 |
15 |
4 |
0 |
1.000 |
21 |
|
H |
114 |
31 |
4791 |
◊ |
G |
x,y,z |
1_555 |
118 |
30 |
4738 |
1135.9 |
-9.4 |
0.200 |
16 |
3 |
0 |
1.000 |
22 |
|
F |
113 |
30 |
4929 |
◊ |
E |
x,y,z |
1_555 |
115 |
29 |
4797 |
1127.3 |
-9.8 |
0.210 |
16 |
4 |
0 |
1.000 |
Average: |
1188.9 |
-10.0 |
0.219 |
18 |
4 |
0 |
1.000 |
2 |
23 |
|
W |
56 |
7 |
13017 |
◊ |
O |
x,y,z |
1_555 |
54 |
17 |
4952 |
481.3 |
-2.4 |
0.735 |
10 |
0 |
0 |
0.023 |
3 |
24 |
|
W |
56 |
7 |
13017 |
◊ |
M |
x,y,z |
1_555 |
54 |
18 |
4931 |
480.8 |
-2.5 |
0.741 |
11 |
0 |
0 |
0.025 |
4 |
25 |
|
W |
56 |
7 |
13017 |
◊ |
V |
x,y,z |
1_555 |
52 |
18 |
4959 |
479.5 |
-1.7 |
0.709 |
9 |
0 |
0 |
0.019 |
5 |
26 |
|
W |
54 |
7 |
13017 |
◊ |
P |
x,y,z |
1_555 |
51 |
18 |
4924 |
479.5 |
-2.4 |
0.750 |
11 |
0 |
0 |
0.025 |
6 |
27 |
|
W |
55 |
7 |
13017 |
◊ |
U |
x,y,z |
1_555 |
50 |
17 |
4904 |
479.3 |
-2.7 |
0.715 |
11 |
0 |
0 |
0.026 |
7 |
28 |
|
W |
55 |
7 |
13017 |
◊ |
R |
x,y,z |
1_555 |
55 |
18 |
4916 |
478.0 |
-2.3 |
0.758 |
12 |
0 |
0 |
0.026 |
8 |
29 |
|
W |
54 |
7 |
13017 |
◊ |
T |
x,y,z |
1_555 |
54 |
18 |
4935 |
476.0 |
-1.9 |
0.747 |
11 |
0 |
0 |
0.023 |
9 |
30 |
|
W |
53 |
6 |
13017 |
◊ |
Q |
x,y,z |
1_555 |
53 |
18 |
4953 |
475.1 |
-2.2 |
0.763 |
14 |
0 |
0 |
0.028 |
10 |
31 |
|
W |
54 |
7 |
13017 |
◊ |
S |
x,y,z |
1_555 |
54 |
18 |
4912 |
473.7 |
-2.8 |
0.735 |
10 |
0 |
0 |
0.025 |
11 |
32 |
|
W |
57 |
7 |
13017 |
◊ |
L |
x,y,z |
1_555 |
49 |
17 |
4934 |
473.5 |
-1.8 |
0.770 |
13 |
0 |
0 |
0.026 |
12 |
33 |
|
W |
59 |
7 |
13017 |
◊ |
N |
x,y,z |
1_555 |
50 |
17 |
4987 |
469.0 |
-2.5 |
0.735 |
10 |
0 |
0 |
0.023 |
13 |
34 |
|
B |
35 |
9 |
4847 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
35 |
9 |
4797 |
383.4 |
3.1 |
0.819 |
3 |
0 |
0 |
0.000 |
14 |
35 |
|
O |
23 |
7 |
4952 |
◊ |
G |
x,y,z |
1_555 |
22 |
7 |
4738 |
216.8 |
2.3 |
0.810 |
3 |
2 |
0 |
0.000 |
36 |
|
Q |
23 |
7 |
4953 |
◊ |
E |
x,y,z |
1_555 |
22 |
7 |
4797 |
211.0 |
1.9 |
0.776 |
3 |
2 |
0 |
0.000 |
37 |
|
M |
19 |
7 |
4931 |
◊ |
I |
x,y,z |
1_555 |
22 |
8 |
4884 |
209.2 |
1.8 |
0.777 |
3 |
1 |
0 |
0.000 |
38 |
|
U |
21 |
7 |
4904 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
4895 |
207.9 |
0.9 |
0.685 |
2 |
2 |
0 |
0.000 |
39 |
|
R |
23 |
7 |
4916 |
◊ |
D |
x,y,z |
1_555 |
22 |
7 |
4804 |
205.5 |
2.1 |
0.811 |
4 |
2 |
0 |
0.000 |
40 |
|
P |
21 |
7 |
4924 |
◊ |
F |
x,y,z |
1_555 |
23 |
8 |
4929 |
204.4 |
1.8 |
0.785 |
3 |
2 |
0 |
0.000 |
41 |
|
S |
21 |
7 |
4912 |
◊ |
C |
x,y,z |
1_555 |
20 |
7 |
4897 |
202.1 |
1.7 |
0.761 |
3 |
1 |
0 |
0.000 |
42 |
|
T |
21 |
7 |
4935 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
4847 |
201.7 |
1.5 |
0.746 |
3 |
1 |
0 |
0.000 |
43 |
|
V |
20 |
7 |
4959 |
◊ |
K |
x,y,z |
1_555 |
21 |
7 |
4755 |
193.2 |
2.1 |
0.795 |
2 |
1 |
0 |
0.000 |
44 |
|
L |
20 |
7 |
4934 |
◊ |
J |
x,y,z |
1_555 |
20 |
7 |
4719 |
185.9 |
2.2 |
0.804 |
2 |
2 |
0 |
0.000 |
45 |
|
N |
17 |
7 |
4987 |
◊ |
H |
x,y,z |
1_555 |
20 |
8 |
4791 |
181.5 |
2.7 |
0.845 |
4 |
2 |
0 |
0.000 |
Average: |
201.7 |
1.9 |
0.781 |
3 |
2 |
0 |
0.000 |
15 |
46 |
|
K |
11 |
4 |
4755 |
◊ |
K |
-x,y,-z |
2_555 |
11 |
4 |
4755 |
104.3 |
-0.3 |
0.535 |
0 |
0 |
0 |
0.000 |
16 |
47 |
|
B |
10 |
4 |
4847 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
10 |
4 |
4804 |
97.6 |
2.3 |
0.861 |
2 |
4 |
0 |
0.000 |
48 |
|
A |
10 |
4 |
4895 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
10 |
4 |
4797 |
93.7 |
2.6 |
0.875 |
2 |
4 |
0 |
0.000 |
Average: |
95.6 |
2.4 |
0.868 |
2 |
4 |
0 |
0.000 |
17 |
49 |
|
J |
9 |
4 |
4719 |
◊ |
A |
-x,y,-z |
2_555 |
9 |
2 |
4895 |
89.7 |
0.6 |
0.664 |
1 |
3 |
0 |
0.000 |
18 |
50 |
|
K |
12 |
5 |
4755 |
◊ |
J |
-x,y,-z |
2_555 |
8 |
4 |
4719 |
86.9 |
-0.2 |
0.551 |
1 |
0 |
0 |
0.000 |
19 |
51 |
|
P |
8 |
4 |
4924 |
◊ |
O |
-x,y,-z+1 |
2_556 |
7 |
4 |
4952 |
83.2 |
2.1 |
0.883 |
2 |
4 |
0 |
0.000 |
52 |
|
V |
6 |
3 |
4959 |
◊ |
T |
-x,y,-z+1 |
2_556 |
8 |
3 |
4935 |
82.7 |
1.5 |
0.837 |
1 |
3 |
0 |
0.000 |
53 |
|
S |
6 |
3 |
4912 |
◊ |
L |
-x,y,-z+1 |
2_556 |
7 |
3 |
4934 |
80.1 |
2.5 |
0.918 |
2 |
4 |
0 |
0.000 |
54 |
|
R |
8 |
4 |
4916 |
◊ |
M |
-x,y,-z+1 |
2_556 |
7 |
4 |
4931 |
78.4 |
2.1 |
0.884 |
1 |
4 |
0 |
0.000 |
55 |
|
U |
6 |
3 |
4904 |
◊ |
U |
-x,y,-z+1 |
2_556 |
6 |
3 |
4904 |
77.2 |
2.2 |
0.908 |
2 |
4 |
0 |
0.000 |
56 |
|
Q |
7 |
4 |
4953 |
◊ |
N |
-x,y,-z+1 |
2_556 |
7 |
4 |
4987 |
63.9 |
0.7 |
0.726 |
0 |
0 |
0 |
0.000 |
Average: |
77.6 |
1.8 |
0.859 |
1 |
3 |
0 |
0.000 |
20 |
57 |
|
O |
9 |
5 |
4952 |
◊ |
O |
-x,y,-z+1 |
2_556 |
9 |
5 |
4952 |
79.9 |
1.7 |
0.840 |
0 |
0 |
0 |
0.000 |
58 |
|
P |
9 |
5 |
4924 |
◊ |
N |
-x,y,-z+1 |
2_556 |
8 |
5 |
4987 |
79.6 |
3.0 |
0.911 |
0 |
0 |
0 |
0.000 |
59 |
|
R |
9 |
5 |
4916 |
◊ |
L |
-x,y,-z+1 |
2_556 |
9 |
5 |
4934 |
61.0 |
1.2 |
0.775 |
0 |
0 |
0 |
0.000 |
60 |
|
U |
9 |
5 |
4904 |
◊ |
T |
-x,y,-z+1 |
2_556 |
8 |
5 |
4935 |
58.6 |
1.9 |
0.823 |
0 |
0 |
0 |
0.000 |
61 |
|
Q |
7 |
4 |
4953 |
◊ |
M |
-x,y,-z+1 |
2_556 |
8 |
5 |
4931 |
53.6 |
1.8 |
0.856 |
0 |
0 |
0 |
0.000 |
62 |
|
V |
9 |
5 |
4959 |
◊ |
S |
-x,y,-z+1 |
2_556 |
9 |
5 |
4912 |
49.7 |
1.1 |
0.772 |
0 |
0 |
0 |
0.000 |
Average: |
63.7 |
1.8 |
0.829 |
0 |
0 |
0 |
0.000 |
21 |
63 |
|
G |
10 |
4 |
4738 |
◊ |
F |
-x,y,-z |
2_555 |
9 |
4 |
4929 |
78.7 |
-0.7 |
0.447 |
1 |
0 |
0 |
0.000 |
22 |
64 |
|
W |
8 |
2 |
13017 |
◊ |
H |
x-1/2,y-1/2,z |
3_445 |
11 |
4 |
4791 |
73.0 |
-1.8 |
0.481 |
0 |
0 |
0 |
0.000 |
23 |
65 |
|
G |
5 |
2 |
4738 |
◊ |
G |
-x,y,-z |
2_555 |
6 |
2 |
4738 |
70.7 |
-0.2 |
0.559 |
0 |
0 |
0 |
0.000 |
24 |
66 |
|
B |
3 |
1 |
4847 |
◊ |
F |
-x-1/2,y-1/2,-z |
4_445 |
5 |
2 |
4929 |
56.8 |
2.2 |
0.897 |
2 |
3 |
0 |
0.000 |
67 |
|
C |
5 |
3 |
4897 |
◊ |
E |
-x-1/2,y-1/2,-z |
4_445 |
6 |
2 |
4797 |
39.8 |
0.7 |
0.726 |
0 |
0 |
0 |
0.000 |
Average: |
48.3 |
1.4 |
0.812 |
1 |
2 |
0 |
0.000 |
25 |
68 |
|
I |
3 |
1 |
4884 |
◊ |
C |
-x,y,-z |
2_555 |
3 |
1 |
4897 |
39.9 |
1.6 |
0.885 |
2 |
4 |
0 |
0.000 |
26 |
69 |
|
S |
5 |
2 |
4912 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
4847 |
32.7 |
0.4 |
0.705 |
0 |
0 |
0 |
0.000 |
70 |
|
L |
5 |
2 |
4934 |
◊ |
I |
x,y,z |
1_555 |
3 |
2 |
4884 |
27.5 |
0.3 |
0.689 |
0 |
0 |
0 |
0.000 |
71 |
|
T |
5 |
2 |
4935 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
4895 |
14.7 |
0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
72 |
|
P |
2 |
1 |
4924 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
4797 |
13.0 |
0.2 |
0.721 |
0 |
0 |
0 |
0.000 |
73 |
|
M |
3 |
2 |
4931 |
◊ |
H |
x,y,z |
1_555 |
3 |
2 |
4791 |
12.9 |
0.2 |
0.691 |
0 |
0 |
0 |
0.000 |
74 |
|
O |
3 |
1 |
4952 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
4929 |
12.7 |
0.2 |
0.715 |
0 |
0 |
0 |
0.000 |
75 |
|
Q |
4 |
2 |
4953 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
4804 |
12.5 |
0.3 |
0.701 |
0 |
0 |
0 |
0.000 |
76 |
|
N |
3 |
1 |
4987 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
4738 |
12.4 |
0.2 |
0.715 |
0 |
0 |
0 |
0.000 |
77 |
|
R |
2 |
1 |
4916 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
4897 |
11.6 |
0.2 |
0.724 |
0 |
0 |
0 |
0.000 |
78 |
|
V |
3 |
1 |
4959 |
◊ |
J |
x,y,z |
1_555 |
2 |
1 |
4719 |
10.2 |
0.2 |
0.708 |
0 |
0 |
0 |
0.000 |
79 |
|
U |
4 |
2 |
4904 |
◊ |
K |
x,y,z |
1_555 |
3 |
2 |
4755 |
9.8 |
0.2 |
0.679 |
0 |
0 |
0 |
0.000 |
Average: |
15.5 |
0.3 |
0.702 |
0 |
0 |
0 |
0.000 |
27 |
80 |
|
F |
2 |
1 |
4929 |
◊ |
F |
-x,y,-z |
2_555 |
2 |
1 |
4929 |
31.4 |
-1.0 |
0.136 |
0 |
0 |
0 |
0.000 |
28 |
81 |
|
N |
1 |
1 |
4987 |
◊ |
I |
x,y,z |
1_555 |
1 |
1 |
4884 |
26.8 |
0.6 |
0.293 |
0 |
0 |
0 |
0.000 |
82 |
|
O |
1 |
1 |
4952 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
4791 |
25.7 |
0.6 |
0.284 |
0 |
0 |
0 |
0.000 |
83 |
|
P |
1 |
1 |
4924 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
4738 |
25.6 |
0.6 |
0.304 |
0 |
0 |
0 |
0.000 |
84 |
|
V |
1 |
1 |
4959 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
4895 |
24.8 |
0.6 |
0.308 |
0 |
0 |
0 |
0.000 |
85 |
|
Q |
1 |
1 |
4953 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
4929 |
24.8 |
0.5 |
0.305 |
0 |
0 |
0 |
0.000 |
86 |
|
U |
1 |
1 |
4904 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
4847 |
24.4 |
0.5 |
0.295 |
0 |
0 |
0 |
0.000 |
87 |
|
M |
1 |
1 |
4931 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
4719 |
24.2 |
0.5 |
0.313 |
0 |
0 |
0 |
0.000 |
88 |
|
S |
1 |
1 |
4912 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
4804 |
23.8 |
0.5 |
0.327 |
0 |
0 |
0 |
0.000 |
89 |
|
R |
1 |
1 |
4916 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
4797 |
23.5 |
0.5 |
0.322 |
0 |
0 |
0 |
0.000 |
90 |
|
L |
1 |
1 |
4934 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
4755 |
23.4 |
0.5 |
0.311 |
0 |
0 |
0 |
0.000 |
91 |
|
T |
1 |
1 |
4935 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
4897 |
23.0 |
0.5 |
0.319 |
0 |
0 |
0 |
0.000 |
Average: |
24.5 |
0.6 |
0.307 |
0 |
0 |
0 |
0.000 |
29 |
92 |
|
W |
5 |
2 |
13017 |
◊ |
J |
x-1/2,y+1/2,z |
3_455 |
4 |
3 |
4719 |
22.5 |
-1.0 |
0.532 |
0 |
0 |
0 |
0.000 |
30 |
93 |
|
H |
5 |
1 |
4791 |
◊ |
E |
-x,y,-z |
2_555 |
3 |
1 |
4797 |
20.7 |
0.2 |
0.661 |
0 |
0 |
0 |
0.000 |
31 |
94 |
|
W |
1 |
1 |
13017 |
◊ |
N |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
1 |
4987 |
7.9 |
-0.4 |
0.394 |
0 |
0 |
0 |
0.000 |
32 |
95 |
|
W |
4 |
2 |
13017 |
◊ |
K |
x-1/2,y+1/2,z |
3_455 |
2 |
2 |
4755 |
6.9 |
0.0 |
0.650 |
0 |
0 |
0 |
0.000 |
33 |
96 |
|
I |
1 |
1 |
4884 |
◊ |
B |
-x,y,-z |
2_555 |
1 |
1 |
4847 |
5.7 |
0.2 |
0.800 |
0 |
0 |
0 |
0.000 |
34 |
97 |
|
S |
1 |
1 |
4912 |
◊ |
W |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
13017 |
3.8 |
-0.1 |
0.417 |
0 |
0 |
0 |
0.000 |
35 |
98 |
|
H |
3 |
1 |
4791 |
◊ |
D |
-x,y,-z |
2_555 |
1 |
1 |
4804 |
3.5 |
0.1 |
0.701 |
0 |
0 |
0 |
0.000 |
|