| ## |
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 |
939 |
235 |
54600 |
◊ |
A |
x,y,z |
1_555 |
987 |
263 |
74283 |
9274.9 |
-93.8 |
0.005 |
116 |
33 |
0 |
0.593 |
2 |
|
G |
237 |
61 |
10379 |
◊ |
D |
x,y,z |
1_555 |
226 |
63 |
13162 |
2181.7 |
-20.5 |
0.077 |
28 |
7 |
0 |
1.000 |
3 |
|
E |
217 |
50 |
13700 |
◊ |
A |
x,y,z |
1_555 |
242 |
74 |
74283 |
2114.3 |
-14.5 |
0.185 |
19 |
8 |
0 |
0.191 |
4 |
|
K |
201 |
45 |
8779 |
◊ |
C |
x,y,z |
1_555 |
203 |
54 |
16969 |
2009.6 |
-34.0 |
0.024 |
8 |
4 |
0 |
1.000 |
5 |
|
F |
217 |
56 |
6203 |
◊ |
A |
x,y,z |
1_555 |
214 |
57 |
74283 |
1913.4 |
-19.3 |
0.166 |
17 |
4 |
0 |
0.217 |
6 |
|
C |
183 |
43 |
16969 |
◊ |
B |
x,y,z |
1_555 |
180 |
45 |
54600 |
1665.7 |
-8.1 |
0.383 |
24 |
12 |
0 |
0.359 |
7 |
|
I |
172 |
42 |
9477 |
◊ |
A |
x,y,z |
1_555 |
176 |
44 |
74283 |
1592.0 |
-14.4 |
0.182 |
17 |
6 |
0 |
0.173 |
8 |
|
J |
147 |
32 |
4994 |
◊ |
B |
x,y,z |
1_555 |
177 |
56 |
54600 |
1518.0 |
-17.6 |
0.195 |
12 |
4 |
0 |
0.947 |
9 |
|
H |
161 |
39 |
9062 |
◊ |
A |
x,y,z |
1_555 |
144 |
43 |
74283 |
1443.9 |
-19.6 |
0.030 |
17 |
4 |
0 |
0.219 |
10 |
|
I |
156 |
39 |
9477 |
◊ |
B |
x,y,z |
1_555 |
157 |
40 |
54600 |
1428.7 |
-15.7 |
0.136 |
6 |
4 |
0 |
0.153 |
11 |
|
J |
108 |
26 |
4994 |
◊ |
C |
x,y,z |
1_555 |
126 |
38 |
16969 |
1084.8 |
-6.1 |
0.558 |
11 |
6 |
0 |
0.207 |
12 |
|
L |
110 |
25 |
4639 |
◊ |
B |
x,y,z |
1_555 |
111 |
38 |
54600 |
1033.7 |
0.3 |
0.723 |
13 |
11 |
0 |
0.000 |
13 |
|
K |
98 |
25 |
8779 |
◊ |
A |
x,y,z |
1_555 |
115 |
31 |
74283 |
955.7 |
-9.6 |
0.349 |
5 |
3 |
0 |
0.029 |
14 |
|
G |
86 |
23 |
10379 |
◊ |
G |
-x+1,y,-z-1/2 |
3_654 |
84 |
23 |
10379 |
816.4 |
-5.6 |
0.381 |
3 |
0 |
0 |
0.000 |
15 |
|
G |
67 |
20 |
10379 |
◊ |
A |
x,y,z |
1_555 |
60 |
16 |
74283 |
592.0 |
-8.0 |
0.102 |
4 |
3 |
0 |
0.019 |
16 |
|
T |
61 |
10 |
4581 |
◊ |
B |
x,y,z |
1_555 |
80 |
30 |
54600 |
570.0 |
-14.8 |
0.334 |
11 |
0 |
0 |
0.260 |
17 |
|
L |
51 |
9 |
4639 |
◊ |
C |
x,y,z |
1_555 |
77 |
19 |
16969 |
559.8 |
-1.7 |
0.556 |
8 |
6 |
0 |
0.000 |
18 |
|
T |
70 |
8 |
4581 |
◊ |
A |
x,y,z |
1_555 |
66 |
22 |
74283 |
548.2 |
-5.6 |
0.790 |
5 |
0 |
0 |
0.024 |
19 |
|
P |
52 |
9 |
2326 |
◊ |
B |
x,y,z |
1_555 |
60 |
27 |
54600 |
497.8 |
-5.9 |
0.806 |
7 |
0 |
0 |
0.073 |
20 |
|
I |
56 |
12 |
9477 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
51 |
16 |
74283 |
464.3 |
0.6 |
0.586 |
10 |
2 |
0 |
0.000 |
21 |
|
G |
51 |
13 |
10379 |
◊ |
F |
x,y,z |
1_555 |
43 |
19 |
6203 |
451.5 |
-3.7 |
0.405 |
3 |
1 |
0 |
0.010 |
22 |
|
K |
43 |
15 |
8779 |
◊ |
B |
x,y,z |
1_555 |
53 |
16 |
54600 |
449.0 |
-2.0 |
0.622 |
4 |
3 |
0 |
0.042 |
23 |
|
P |
44 |
10 |
2326 |
◊ |
T |
x,y,z |
1_555 |
48 |
10 |
4581 |
433.5 |
-9.2 |
0.744 |
18 |
0 |
0 |
0.139 |
24 |
|
C |
44 |
11 |
16969 |
◊ |
A |
x,-y,-z |
4_555 |
42 |
10 |
74283 |
381.0 |
-0.7 |
0.594 |
6 |
2 |
0 |
0.000 |
25 |
|
N |
32 |
8 |
1892 |
◊ |
T |
x,y,z |
1_555 |
38 |
9 |
4581 |
350.4 |
-3.8 |
0.764 |
18 |
0 |
0 |
0.076 |
26 |
|
D |
36 |
13 |
13162 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
35 |
12 |
74283 |
340.2 |
2.4 |
0.800 |
2 |
9 |
0 |
0.000 |
27 |
|
C |
39 |
9 |
16969 |
◊ |
A |
x,y,z |
1_555 |
40 |
14 |
74283 |
337.2 |
-1.3 |
0.559 |
5 |
0 |
0 |
0.011 |
28 |
|
N |
38 |
6 |
1892 |
◊ |
A |
x,y,z |
1_555 |
30 |
12 |
74283 |
270.3 |
-2.5 |
0.646 |
1 |
0 |
0 |
0.007 |
29 |
|
D |
27 |
7 |
13162 |
◊ |
B |
x,y,z |
1_555 |
36 |
12 |
54600 |
265.8 |
-0.0 |
0.630 |
2 |
2 |
0 |
0.000 |
30 |
|
P |
37 |
5 |
2326 |
◊ |
A |
x,y,z |
1_555 |
38 |
13 |
74283 |
260.9 |
0.1 |
0.892 |
5 |
0 |
0 |
0.006 |
31 |
|
[BRU]T:22 |
19 |
1 |
446 |
cf |
T |
x,y,z |
1_555 |
27 |
2 |
4581 |
212.3 |
4.0 |
0.802 |
0 |
0 |
0 |
0.000 |
32 |
|
K |
21 |
7 |
8779 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
9062 |
191.8 |
-1.2 |
0.530 |
1 |
0 |
0 |
0.004 |
33 |
|
H |
18 |
5 |
9062 |
◊ |
C |
x,y,z |
1_555 |
25 |
5 |
16969 |
186.2 |
-1.5 |
0.417 |
0 |
0 |
0 |
0.003 |
34 |
|
D |
20 |
5 |
13162 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
74283 |
182.6 |
-1.8 |
0.318 |
0 |
0 |
0 |
0.000 |
35 |
|
F |
17 |
5 |
6203 |
◊ |
E |
x,y,z |
1_555 |
12 |
5 |
13700 |
148.0 |
-0.0 |
0.556 |
1 |
2 |
0 |
0.006 |
36 |
|
F |
15 |
6 |
6203 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
54600 |
122.2 |
1.6 |
0.827 |
1 |
1 |
0 |
0.000 |
37 |
|
L |
13 |
5 |
4639 |
◊ |
L |
x,-y,-z |
4_555 |
13 |
5 |
4639 |
117.8 |
1.4 |
0.738 |
2 |
0 |
0 |
0.000 |
38 |
|
G |
15 |
5 |
10379 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
54600 |
104.5 |
-0.6 |
0.544 |
1 |
0 |
0 |
0.002 |
39 |
|
[BRU]T:22 |
10 |
1 |
446 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
74283 |
95.9 |
1.1 |
0.642 |
3 |
0 |
0 |
0.000 |
40 |
|
L |
12 |
5 |
4639 |
◊ |
B |
x,-y,-z |
4_555 |
12 |
4 |
54600 |
81.8 |
-0.7 |
0.505 |
1 |
0 |
0 |
0.000 |
41 |
|
L |
11 |
5 |
4639 |
◊ |
J |
x,y,z |
1_555 |
5 |
2 |
4994 |
76.4 |
-0.5 |
0.460 |
1 |
0 |
0 |
0.000 |
42 |
|
[BRU]T:22 |
9 |
1 |
446 |
◊ |
P |
x,y,z |
1_555 |
10 |
3 |
2326 |
72.9 |
1.7 |
0.731 |
1 |
0 |
0 |
0.000 |
43 |
|
[BRU]T:22 |
6 |
1 |
446 |
◊ |
B |
x,y,z |
1_555 |
13 |
7 |
54600 |
69.2 |
-2.5 |
0.233 |
1 |
0 |
0 |
0.039 |
44 |
|
N |
6 |
1 |
1892 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
54600 |
54.8 |
-0.4 |
0.587 |
1 |
0 |
0 |
0.005 |
45 |
|
[ZN]A:2459 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
4 |
3 |
4639 |
49.7 |
-39.2 |
0.000 |
0 |
0 |
0 |
0.100 |
46 |
|
[ZN]A:2461 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
6 |
5 |
9477 |
49.7 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.316 |
47 |
|
[ZN]A:2464 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
3 |
74283 |
49.1 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.309 |
48 |
|
E |
7 |
3 |
13700 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
54600 |
47.4 |
-1.4 |
0.205 |
0 |
0 |
0 |
0.005 |
49 |
|
[MG]A:2457 |
1 |
1 |
98 |
◊ |
P |
x,y,z |
1_555 |
4 |
1 |
2326 |
34.4 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.011 |
50 |
|
[MG]A:2457 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
74283 |
34.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.032 |
51 |
|
C |
5 |
3 |
16969 |
◊ |
B |
x,-y,-z |
4_555 |
5 |
2 |
54600 |
32.2 |
0.2 |
0.576 |
0 |
0 |
0 |
0.000 |
52 |
|
L |
2 |
1 |
4639 |
◊ |
K |
x,y,z |
1_555 |
4 |
2 |
8779 |
24.6 |
0.1 |
0.598 |
0 |
0 |
0 |
0.000 |
53 |
|
[MG]A:2457 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
54600 |
15.1 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.007 |
54 |
|
H |
2 |
1 |
9062 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
54600 |
14.7 |
0.3 |
0.491 |
0 |
0 |
0 |
0.000 |
55 |
|
G |
1 |
1 |
10379 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
2 |
2 |
74283 |
14.1 |
0.2 |
0.738 |
0 |
0 |
0 |
0.000 |
56 |
|
[ZN]A:2462 |
1 |
1 |
98 |
f |
A |
x,-y,-z |
4_555 |
1 |
1 |
74283 |
9.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.026 |
57 |
|
F |
2 |
1 |
6203 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
13162 |
4.5 |
0.0 |
0.640 |
0 |
0 |
0 |
0.000 |
58 |
|
[ZN]A:2458 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
54600 |
2.7 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.088 |
59 |
|
[ZN]A:2465 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
54600 |
0.4 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.012 |
60 |
|
G |
1 |
1 |
10379 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
54600 |
0.1 |
0.0 |
0.675 |
0 |
0 |
0 |
0.000 |
|