## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
941 |
235 |
54590 |
◊ |
A |
x,y,z |
1_555 |
998 |
266 |
74310 |
9319.1 |
-98.6 |
0.002 |
118 |
31 |
0 |
0.454 |
2 |
|
G |
237 |
60 |
10379 |
◊ |
D |
x,y,z |
1_555 |
226 |
63 |
13165 |
2170.4 |
-19.9 |
0.083 |
28 |
7 |
0 |
1.000 |
3 |
|
E |
212 |
50 |
13666 |
◊ |
A |
x,y,z |
1_555 |
250 |
75 |
74310 |
2084.5 |
-13.2 |
0.217 |
20 |
8 |
0 |
0.321 |
4 |
|
K |
201 |
45 |
8792 |
◊ |
C |
x,y,z |
1_555 |
204 |
53 |
16946 |
2013.9 |
-33.2 |
0.031 |
12 |
6 |
0 |
1.000 |
5 |
|
F |
212 |
55 |
6208 |
◊ |
A |
x,y,z |
1_555 |
214 |
56 |
74310 |
1910.8 |
-18.9 |
0.181 |
18 |
4 |
0 |
0.144 |
6 |
|
C |
188 |
42 |
16946 |
◊ |
B |
x,y,z |
1_555 |
184 |
46 |
54590 |
1679.4 |
-8.9 |
0.426 |
25 |
12 |
0 |
0.362 |
7 |
|
I |
171 |
42 |
9447 |
◊ |
A |
x,y,z |
1_555 |
179 |
43 |
74310 |
1587.4 |
-14.4 |
0.186 |
20 |
6 |
0 |
0.127 |
8 |
|
J |
150 |
32 |
4988 |
◊ |
B |
x,y,z |
1_555 |
178 |
56 |
54590 |
1529.2 |
-18.3 |
0.176 |
12 |
3 |
0 |
0.932 |
9 |
|
H |
155 |
38 |
9059 |
◊ |
A |
x,y,z |
1_555 |
143 |
44 |
74310 |
1439.7 |
-19.4 |
0.028 |
15 |
4 |
0 |
0.140 |
10 |
|
I |
157 |
39 |
9447 |
◊ |
B |
x,y,z |
1_555 |
161 |
41 |
54590 |
1424.2 |
-15.7 |
0.140 |
7 |
4 |
0 |
0.323 |
11 |
|
J |
107 |
27 |
4988 |
◊ |
C |
x,y,z |
1_555 |
124 |
39 |
16946 |
1081.7 |
-6.4 |
0.541 |
12 |
6 |
0 |
1.000 |
12 |
|
L |
113 |
26 |
4615 |
◊ |
B |
x,y,z |
1_555 |
116 |
38 |
54590 |
1030.2 |
0.2 |
0.721 |
16 |
12 |
0 |
0.018 |
13 |
|
K |
96 |
25 |
8792 |
◊ |
A |
x,y,z |
1_555 |
113 |
30 |
74310 |
959.9 |
-9.5 |
0.344 |
7 |
3 |
0 |
0.209 |
14 |
|
G |
80 |
22 |
10379 |
◊ |
G |
-x+1,y,-z-1/2 |
3_654 |
79 |
22 |
10379 |
762.7 |
-5.6 |
0.357 |
2 |
0 |
0 |
0.000 |
15 |
|
T |
68 |
12 |
4506 |
◊ |
B |
x,y,z |
1_555 |
84 |
31 |
54590 |
629.4 |
-16.3 |
0.276 |
8 |
0 |
0 |
0.251 |
16 |
|
T |
72 |
8 |
4506 |
◊ |
A |
x,y,z |
1_555 |
69 |
23 |
74310 |
599.9 |
-6.7 |
0.710 |
8 |
0 |
0 |
0.099 |
17 |
|
G |
65 |
20 |
10379 |
◊ |
A |
x,y,z |
1_555 |
58 |
16 |
74310 |
579.5 |
-7.7 |
0.104 |
4 |
4 |
0 |
0.021 |
18 |
|
L |
51 |
10 |
4615 |
◊ |
C |
x,y,z |
1_555 |
75 |
19 |
16946 |
565.5 |
-0.8 |
0.610 |
9 |
11 |
0 |
0.013 |
19 |
|
I |
59 |
12 |
9447 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
55 |
16 |
74310 |
484.4 |
0.5 |
0.573 |
11 |
2 |
0 |
0.000 |
20 |
|
K |
46 |
15 |
8792 |
◊ |
B |
x,y,z |
1_555 |
57 |
16 |
54590 |
461.0 |
-1.8 |
0.646 |
3 |
3 |
0 |
0.035 |
21 |
|
P |
56 |
9 |
2286 |
◊ |
B |
x,y,z |
1_555 |
51 |
23 |
54590 |
454.8 |
-3.0 |
0.864 |
5 |
0 |
0 |
0.048 |
22 |
|
G |
49 |
13 |
10379 |
◊ |
F |
x,y,z |
1_555 |
43 |
18 |
6208 |
441.4 |
-3.5 |
0.415 |
3 |
1 |
0 |
0.000 |
23 |
|
P |
42 |
10 |
2286 |
◊ |
T |
x,y,z |
1_555 |
49 |
9 |
4506 |
427.2 |
-6.7 |
0.751 |
18 |
0 |
0 |
0.142 |
24 |
|
C |
43 |
10 |
16946 |
◊ |
A |
x,-y,-z |
4_555 |
43 |
10 |
74310 |
367.7 |
-0.8 |
0.590 |
7 |
2 |
0 |
0.000 |
25 |
|
N |
32 |
8 |
1857 |
◊ |
T |
x,y,z |
1_555 |
32 |
9 |
4506 |
338.8 |
-5.8 |
0.566 |
15 |
0 |
0 |
0.120 |
26 |
|
C |
39 |
9 |
16946 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
74310 |
337.0 |
-1.2 |
0.570 |
5 |
0 |
0 |
0.008 |
27 |
|
D |
34 |
12 |
13165 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
35 |
11 |
74310 |
310.7 |
2.1 |
0.778 |
2 |
5 |
0 |
0.000 |
28 |
|
N |
37 |
6 |
1857 |
◊ |
A |
x,y,z |
1_555 |
32 |
12 |
74310 |
275.9 |
-2.1 |
0.639 |
1 |
0 |
0 |
0.024 |
29 |
|
D |
29 |
7 |
13165 |
◊ |
B |
x,y,z |
1_555 |
33 |
12 |
54590 |
271.1 |
0.1 |
0.634 |
2 |
2 |
0 |
0.000 |
30 |
|
P |
35 |
5 |
2286 |
◊ |
A |
x,y,z |
1_555 |
33 |
14 |
74310 |
259.9 |
-0.2 |
0.864 |
5 |
0 |
0 |
0.024 |
31 |
|
[BRU]T:22 |
19 |
1 |
451 |
cf |
T |
x,y,z |
1_555 |
28 |
2 |
4506 |
220.3 |
4.1 |
0.792 |
0 |
0 |
0 |
0.000 |
32 |
|
K |
20 |
7 |
8792 |
◊ |
H |
x,y,z |
1_555 |
20 |
7 |
9059 |
192.3 |
-1.3 |
0.513 |
0 |
0 |
0 |
0.003 |
33 |
|
H |
17 |
5 |
9059 |
◊ |
C |
x,y,z |
1_555 |
26 |
5 |
16946 |
179.1 |
-1.6 |
0.415 |
0 |
0 |
0 |
0.004 |
34 |
|
D |
19 |
6 |
13165 |
◊ |
A |
x,y,z |
1_555 |
20 |
8 |
74310 |
171.6 |
-1.8 |
0.344 |
0 |
0 |
0 |
0.000 |
35 |
|
F |
18 |
6 |
6208 |
◊ |
E |
x,y,z |
1_555 |
12 |
5 |
13666 |
144.6 |
0.2 |
0.610 |
1 |
2 |
0 |
0.003 |
36 |
|
L |
14 |
5 |
4615 |
◊ |
L |
x,-y,-z |
4_555 |
14 |
5 |
4615 |
123.6 |
1.5 |
0.744 |
4 |
0 |
0 |
0.000 |
37 |
|
F |
15 |
6 |
6208 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
54590 |
116.8 |
1.5 |
0.817 |
1 |
1 |
0 |
0.000 |
38 |
|
G |
13 |
5 |
10379 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
54590 |
111.1 |
-0.4 |
0.561 |
1 |
0 |
0 |
0.002 |
39 |
|
L |
11 |
5 |
4615 |
◊ |
B |
x,-y,-z |
4_555 |
13 |
5 |
54590 |
90.1 |
-0.8 |
0.467 |
1 |
0 |
0 |
0.000 |
40 |
|
[BRU]T:22 |
10 |
1 |
451 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
74310 |
90.0 |
1.1 |
0.634 |
2 |
0 |
0 |
0.000 |
41 |
|
[BRU]T:22 |
7 |
1 |
451 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
54590 |
75.2 |
-2.6 |
0.228 |
1 |
0 |
0 |
0.039 |
42 |
|
L |
11 |
5 |
4615 |
◊ |
J |
x,y,z |
1_555 |
4 |
2 |
4988 |
74.9 |
-0.5 |
0.443 |
1 |
0 |
0 |
0.002 |
43 |
|
[BRU]T:22 |
10 |
1 |
451 |
◊ |
P |
x,y,z |
1_555 |
9 |
3 |
2286 |
69.4 |
1.6 |
0.685 |
2 |
0 |
0 |
0.000 |
44 |
|
E |
7 |
3 |
13666 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
54590 |
51.1 |
-1.4 |
0.198 |
0 |
0 |
0 |
0.003 |
45 |
|
[ZN]A:2461 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
8 |
5 |
9447 |
50.5 |
-39.0 |
0.000 |
0 |
0 |
0 |
0.648 |
46 |
|
[ZN]A:2464 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
74310 |
49.0 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.629 |
47 |
|
N |
2 |
1 |
1857 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
54590 |
41.4 |
1.4 |
0.844 |
0 |
0 |
0 |
0.000 |
48 |
|
[MG]A:2457 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
74310 |
39.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.089 |
49 |
|
C |
5 |
3 |
16946 |
◊ |
B |
x,-y,-z |
4_555 |
5 |
2 |
54590 |
36.3 |
0.4 |
0.618 |
0 |
0 |
0 |
0.000 |
50 |
|
[MG]A:2457 |
1 |
1 |
98 |
◊ |
P |
x,y,z |
1_555 |
5 |
1 |
2286 |
30.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.038 |
51 |
|
L |
2 |
1 |
4615 |
◊ |
K |
x,y,z |
1_555 |
3 |
2 |
8792 |
21.5 |
0.0 |
0.573 |
0 |
0 |
0 |
0.000 |
52 |
|
H |
2 |
1 |
9059 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
54590 |
15.8 |
0.3 |
0.349 |
0 |
0 |
0 |
0.000 |
53 |
|
G |
1 |
1 |
10379 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
2 |
2 |
74310 |
15.1 |
0.2 |
0.764 |
0 |
0 |
0 |
0.000 |
54 |
|
[ZN]A:2462 |
1 |
1 |
98 |
f |
A |
x,-y,-z |
4_555 |
1 |
1 |
74310 |
12.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.072 |
55 |
|
F |
2 |
1 |
6208 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
13165 |
8.5 |
0.0 |
0.659 |
0 |
0 |
0 |
0.000 |
56 |
|
[MG]A:2457 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
54590 |
5.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
57 |
|
[ZN]A:2458 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
54590 |
4.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.068 |
58 |
|
G |
1 |
1 |
10379 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
54590 |
1.7 |
0.1 |
0.757 |
0 |
0 |
0 |
0.000 |
|