| ## |
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 |
|
A |
377 |
74 |
211459 |
◊ |
L |
x,y,z |
1_555 |
321 |
77 |
9456 |
3193.8 |
-62.5 |
0.813 |
59 |
0 |
0 |
0.144 |
2 |
|
A |
370 |
60 |
211459 |
◊ |
D |
x,y,z |
1_555 |
296 |
78 |
12136 |
2970.7 |
-49.5 |
0.841 |
79 |
0 |
0 |
0.147 |
3 |
|
A |
319 |
62 |
211459 |
◊ |
I |
x,y,z |
1_555 |
258 |
59 |
8411 |
2784.0 |
-57.0 |
0.681 |
62 |
0 |
0 |
0.157 |
4 |
|
A |
333 |
59 |
211459 |
◊ |
Q |
x,y,z |
1_555 |
248 |
54 |
7812 |
2652.2 |
-47.1 |
0.716 |
40 |
0 |
0 |
0.142 |
5 |
|
A |
302 |
63 |
211459 |
◊ |
T |
x,y,z |
1_555 |
254 |
61 |
7067 |
2564.5 |
-52.6 |
0.653 |
39 |
0 |
0 |
0.145 |
6 |
|
A |
300 |
51 |
211459 |
◊ |
P |
x,y,z |
1_555 |
243 |
56 |
5631 |
2536.8 |
-47.0 |
0.619 |
45 |
0 |
0 |
0.141 |
7 |
|
A |
245 |
42 |
211459 |
◊ |
E |
x,y,z |
1_555 |
198 |
56 |
8632 |
2044.4 |
-36.7 |
0.717 |
43 |
0 |
0 |
0.127 |
8 |
|
A |
225 |
38 |
211459 |
◊ |
M |
x,y,z |
1_555 |
194 |
51 |
8378 |
1983.5 |
-50.2 |
0.417 |
51 |
0 |
0 |
0.146 |
9 |
|
A |
253 |
48 |
211459 |
◊ |
N |
x,y,z |
1_555 |
170 |
37 |
5730 |
1898.2 |
-34.5 |
0.823 |
42 |
0 |
0 |
0.141 |
10 |
|
A |
229 |
43 |
211459 |
◊ |
G |
x,y,z |
1_555 |
181 |
45 |
10642 |
1839.9 |
-28.3 |
0.833 |
34 |
0 |
0 |
0.158 |
11 |
|
A |
230 |
40 |
211459 |
◊ |
H |
x,y,z |
1_555 |
190 |
51 |
8400 |
1828.9 |
-30.7 |
0.545 |
31 |
0 |
0 |
0.162 |
12 |
|
A |
223 |
40 |
211459 |
◊ |
K |
x,y,z |
1_555 |
167 |
43 |
7353 |
1809.3 |
-32.0 |
0.797 |
35 |
0 |
0 |
0.130 |
13 |
|
A |
239 |
46 |
211459 |
◊ |
J |
x,y,z |
1_555 |
171 |
44 |
7604 |
1804.5 |
-32.4 |
0.843 |
28 |
0 |
0 |
0.124 |
14 |
|
A |
213 |
39 |
211459 |
◊ |
O |
x,y,z |
1_555 |
175 |
44 |
6604 |
1795.8 |
-34.3 |
0.682 |
34 |
0 |
0 |
0.131 |
15 |
|
A |
207 |
37 |
211459 |
◊ |
C |
x,y,z |
1_555 |
160 |
45 |
11841 |
1688.3 |
-33.9 |
0.650 |
27 |
0 |
0 |
0.127 |
16 |
|
A |
201 |
40 |
211459 |
◊ |
S |
x,y,z |
1_555 |
153 |
27 |
6113 |
1592.3 |
-21.9 |
0.760 |
31 |
0 |
0 |
0.130 |
17 |
|
A |
145 |
34 |
211459 |
◊ |
U |
x,y,z |
1_555 |
117 |
22 |
2387 |
1259.1 |
-27.5 |
0.363 |
32 |
0 |
0 |
0.152 |
18 |
|
R |
109 |
26 |
5783 |
◊ |
F |
x,y,z |
1_555 |
107 |
23 |
7094 |
1017.8 |
-7.7 |
0.155 |
12 |
2 |
0 |
0.048 |
19 |
|
A |
122 |
27 |
211459 |
◊ |
B |
x,y,z |
1_555 |
106 |
33 |
12534 |
987.3 |
-13.1 |
0.861 |
17 |
0 |
0 |
0.075 |
20 |
|
A |
128 |
24 |
211459 |
x |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
129 |
27 |
211459 |
963.9 |
-25.4 |
0.911 |
8 |
0 |
0 |
0.000 |
21 |
|
A |
109 |
25 |
211459 |
◊ |
R |
x,y,z |
1_555 |
91 |
22 |
5783 |
947.1 |
-24.8 |
0.347 |
20 |
0 |
0 |
0.122 |
22 |
|
N |
88 |
20 |
5730 |
◊ |
C |
x,y,z |
1_555 |
106 |
28 |
11841 |
876.7 |
-9.2 |
0.181 |
4 |
0 |
0 |
0.385 |
23 |
|
N |
79 |
19 |
5730 |
◊ |
J |
x,y,z |
1_555 |
89 |
18 |
7604 |
782.7 |
-7.8 |
0.259 |
10 |
6 |
0 |
0.459 |
24 |
|
H |
67 |
19 |
8400 |
◊ |
E |
x,y,z |
1_555 |
65 |
18 |
8632 |
628.2 |
-0.2 |
0.521 |
7 |
3 |
0 |
0.009 |
25 |
|
A |
65 |
14 |
211459 |
◊ |
F |
x,y,z |
1_555 |
70 |
19 |
7094 |
586.7 |
-7.7 |
0.774 |
12 |
0 |
0 |
0.047 |
26 |
|
a |
56 |
7 |
1791 |
◊ |
A |
x,y,z |
1_555 |
57 |
15 |
211459 |
455.5 |
-1.6 |
0.945 |
9 |
0 |
0 |
0.000 |
27 |
|
B |
46 |
14 |
12534 |
◊ |
B |
y,x,-z |
7_555 |
46 |
14 |
12534 |
427.5 |
3.0 |
0.814 |
6 |
6 |
0 |
0.000 |
28 |
|
S |
45 |
10 |
6113 |
◊ |
M |
x,y,z |
1_555 |
41 |
12 |
8378 |
426.3 |
-1.8 |
0.495 |
1 |
0 |
0 |
0.000 |
29 |
|
J |
46 |
14 |
7604 |
◊ |
C |
x,y,z |
1_555 |
52 |
15 |
11841 |
423.8 |
-4.0 |
0.308 |
1 |
0 |
0 |
0.155 |
30 |
|
E |
40 |
13 |
8632 |
◊ |
D |
x,y,z |
1_555 |
40 |
11 |
12136 |
373.3 |
0.5 |
0.480 |
2 |
2 |
0 |
0.001 |
31 |
|
W |
42 |
6 |
2403 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
211459 |
346.4 |
-4.0 |
0.777 |
0 |
0 |
0 |
0.000 |
32 |
|
[SRY]A:1928 |
26 |
1 |
698 |
f |
A |
x,y,z |
1_555 |
47 |
13 |
211459 |
339.6 |
-10.0 |
0.687 |
3 |
0 |
0 |
0.041 |
33 |
|
R |
35 |
9 |
5783 |
◊ |
K |
x,y,z |
1_555 |
35 |
12 |
7353 |
336.4 |
-0.9 |
0.531 |
4 |
0 |
0 |
0.007 |
34 |
|
H |
35 |
11 |
8400 |
◊ |
D |
y,x,-z |
7_555 |
36 |
13 |
12136 |
323.3 |
7.1 |
0.838 |
7 |
8 |
0 |
0.000 |
35 |
|
[2MG]A:1207 |
24 |
1 |
517 |
cf |
A |
x,y,z |
1_555 |
53 |
9 |
211459 |
310.4 |
2.6 |
0.913 |
5 |
0 |
0 |
0.000 |
36 |
|
[4OC]A:1402 |
22 |
1 |
492 |
cf |
A |
x,y,z |
1_555 |
43 |
7 |
211459 |
308.2 |
1.1 |
0.767 |
2 |
0 |
0 |
0.000 |
37 |
|
A |
38 |
8 |
211459 |
◊ |
M |
-y+1/2,x-1/2,z+1/4 |
3_545 |
42 |
13 |
8378 |
304.0 |
-7.0 |
0.387 |
1 |
0 |
0 |
0.000 |
38 |
|
[MA6]A:1518 |
23 |
1 |
519 |
cf |
A |
x,y,z |
1_555 |
47 |
5 |
211459 |
294.0 |
3.7 |
0.698 |
0 |
0 |
0 |
0.000 |
39 |
|
[PSU]A:516 |
20 |
1 |
431 |
cf |
A |
x,y,z |
1_555 |
41 |
6 |
211459 |
272.6 |
-1.8 |
0.777 |
2 |
0 |
0 |
0.010 |
40 |
|
[MA6]A:1519 |
20 |
1 |
525 |
cf |
A |
x,y,z |
1_555 |
52 |
9 |
211459 |
272.2 |
1.0 |
0.630 |
0 |
0 |
0 |
0.000 |
41 |
|
[7MG]A:527 |
24 |
1 |
498 |
cf |
A |
x,y,z |
1_555 |
41 |
6 |
211459 |
272.0 |
3.6 |
0.894 |
4 |
0 |
0 |
0.000 |
42 |
|
[5MC]A:1404 |
21 |
1 |
460 |
cf |
A |
x,y,z |
1_555 |
39 |
5 |
211459 |
270.3 |
1.8 |
0.904 |
4 |
0 |
0 |
0.000 |
43 |
|
H |
26 |
7 |
8400 |
◊ |
B |
x,y,z |
1_555 |
44 |
9 |
12534 |
264.5 |
-0.2 |
0.526 |
5 |
2 |
0 |
0.010 |
44 |
|
E |
34 |
10 |
8632 |
◊ |
E |
y,x,-z |
7_555 |
34 |
10 |
8632 |
262.9 |
4.3 |
0.841 |
4 |
0 |
0 |
0.000 |
45 |
|
I |
27 |
9 |
8411 |
◊ |
G |
x,y,z |
1_555 |
26 |
7 |
10642 |
260.6 |
-3.8 |
0.139 |
1 |
0 |
0 |
0.000 |
46 |
|
[UR3]A:1498 |
18 |
1 |
457 |
cf |
A |
x,y,z |
1_555 |
33 |
6 |
211459 |
257.6 |
-1.0 |
0.770 |
3 |
0 |
0 |
0.008 |
47 |
|
[5MC]A:1407 |
21 |
1 |
447 |
cf |
A |
x,y,z |
1_555 |
33 |
5 |
211459 |
241.8 |
1.3 |
0.895 |
3 |
0 |
0 |
0.000 |
48 |
|
K |
29 |
7 |
7353 |
◊ |
G |
x,y,z |
1_555 |
27 |
6 |
10642 |
233.2 |
-2.7 |
0.319 |
1 |
0 |
0 |
0.008 |
49 |
|
Q |
20 |
5 |
7812 |
◊ |
L |
x,y,z |
1_555 |
22 |
7 |
9456 |
211.8 |
-3.2 |
0.205 |
1 |
0 |
0 |
0.006 |
50 |
|
K |
25 |
8 |
7353 |
◊ |
A |
x,y,z-1 |
1_554 |
25 |
4 |
211459 |
211.1 |
1.3 |
0.861 |
4 |
0 |
0 |
0.000 |
51 |
|
V |
30 |
4 |
1050 |
◊ |
A |
x,y,z |
1_555 |
30 |
7 |
211459 |
210.9 |
-3.1 |
0.897 |
0 |
0 |
0 |
0.000 |
52 |
|
J |
22 |
5 |
7604 |
◊ |
J |
-y+1,-x+1,-z+1/2 |
8_665 |
22 |
5 |
7604 |
187.9 |
4.0 |
0.883 |
6 |
4 |
0 |
0.000 |
53 |
|
[5MC]A:967 |
16 |
1 |
448 |
cf |
A |
x,y,z |
1_555 |
25 |
5 |
211459 |
186.1 |
-0.5 |
0.711 |
0 |
0 |
0 |
0.002 |
54 |
|
J |
26 |
8 |
7604 |
◊ |
I |
x,y,z |
1_555 |
19 |
5 |
8411 |
182.5 |
-0.1 |
0.394 |
1 |
0 |
0 |
0.000 |
55 |
|
b |
20 |
3 |
865 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
211459 |
180.4 |
-3.0 |
0.852 |
2 |
0 |
0 |
0.000 |
56 |
|
W |
25 |
4 |
2403 |
◊ |
V |
x,y,z |
1_555 |
19 |
4 |
1050 |
177.8 |
-3.6 |
0.674 |
2 |
0 |
0 |
0.000 |
57 |
|
A |
22 |
5 |
211459 |
◊ |
I |
-y+1/2,x-1/2,z+1/4 |
3_545 |
11 |
3 |
8411 |
163.5 |
-2.4 |
0.630 |
5 |
0 |
0 |
0.000 |
58 |
|
[5MC]A:967 |
18 |
1 |
448 |
cf |
[M2G]A:966 |
x,y,z |
1_555 |
20 |
1 |
536 |
144.5 |
0.4 |
0.774 |
0 |
0 |
0 |
0.000 |
59 |
|
[MA6]A:1519 |
20 |
1 |
525 |
cf |
[MA6]A:1518 |
x,y,z |
1_555 |
16 |
1 |
519 |
143.8 |
4.3 |
0.467 |
0 |
0 |
0 |
0.000 |
60 |
|
[PSU]a:40 |
15 |
1 |
450 |
◊ |
A |
x,y,z |
1_555 |
20 |
4 |
211459 |
141.4 |
-3.0 |
0.633 |
4 |
0 |
0 |
0.000 |
61 |
|
[PSU]W:40 |
12 |
1 |
442 |
cf |
W |
x,y,z |
1_555 |
21 |
3 |
2403 |
140.7 |
0.5 |
0.737 |
4 |
0 |
0 |
0.100 |
62 |
|
A |
18 |
4 |
211459 |
◊ |
b |
-y+1/2,x-1/2,z+1/4 |
3_545 |
16 |
3 |
865 |
134.3 |
-7.6 |
0.536 |
2 |
0 |
0 |
0.031 |
63 |
|
[PSU]A:1540 |
11 |
1 |
430 |
cf |
A |
x,y,z |
1_555 |
19 |
3 |
211459 |
128.7 |
-0.3 |
0.730 |
1 |
0 |
0 |
0.003 |
64 |
|
[PSU]a:40 |
15 |
1 |
450 |
cf |
a |
x,y,z |
1_555 |
19 |
2 |
1791 |
127.8 |
1.6 |
0.788 |
0 |
0 |
0 |
0.000 |
65 |
|
Q |
16 |
6 |
7812 |
◊ |
H |
x,y,z |
1_555 |
17 |
4 |
8400 |
120.2 |
-0.3 |
0.527 |
1 |
0 |
0 |
0.002 |
66 |
|
[5MC]A:1400 |
9 |
1 |
448 |
cf |
A |
x,y,z |
1_555 |
15 |
3 |
211459 |
114.8 |
0.4 |
0.749 |
0 |
0 |
0 |
0.000 |
67 |
|
[M2G]A:966 |
8 |
1 |
536 |
cf |
A |
x,y,z |
1_555 |
18 |
5 |
211459 |
107.0 |
-0.5 |
0.750 |
0 |
0 |
0 |
0.002 |
68 |
|
[SRY]A:1928 |
11 |
1 |
698 |
◊ |
L |
x,y,z |
1_555 |
11 |
5 |
9456 |
105.3 |
-1.9 |
0.519 |
1 |
0 |
0 |
0.004 |
69 |
|
[UR3]A:1498 |
14 |
1 |
457 |
◊ |
b |
x,y,z |
1_555 |
14 |
3 |
865 |
103.9 |
-3.9 |
0.637 |
0 |
0 |
0 |
0.000 |
70 |
|
[5MC]A:1400 |
13 |
1 |
448 |
◊ |
b |
x,y,z |
1_555 |
11 |
1 |
865 |
85.1 |
-0.3 |
0.728 |
0 |
0 |
0 |
0.000 |
71 |
|
U |
7 |
3 |
2387 |
◊ |
M |
x,y,z |
1_555 |
6 |
3 |
8378 |
85.1 |
0.0 |
0.464 |
0 |
0 |
0 |
0.000 |
72 |
|
A |
10 |
2 |
211459 |
◊ |
G |
-y+1/2,x-1/2,z+1/4 |
3_545 |
9 |
3 |
10642 |
82.5 |
-3.5 |
0.343 |
1 |
0 |
0 |
0.000 |
73 |
|
A |
10 |
1 |
211459 |
◊ |
[M2G]A:966 |
-y+1/2,x-1/2,z+1/4 |
3_545 |
13 |
1 |
536 |
77.2 |
-0.2 |
0.746 |
0 |
0 |
0 |
0.000 |
74 |
|
E |
8 |
2 |
8632 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
11841 |
74.3 |
1.4 |
0.763 |
2 |
3 |
0 |
0.000 |
75 |
|
A |
8 |
2 |
211459 |
◊ |
[5MC]A:1400 |
-y+1/2,x-1/2,z+1/4 |
3_545 |
13 |
1 |
448 |
71.8 |
-2.0 |
0.469 |
1 |
0 |
0 |
0.000 |
76 |
|
[SRY]A:1928 |
10 |
1 |
698 |
f |
[7MG]A:527 |
x,y,z |
1_555 |
5 |
1 |
498 |
71.6 |
-4.0 |
0.279 |
0 |
0 |
0 |
0.015 |
77 |
|
V |
10 |
2 |
1050 |
◊ |
L |
x,y,z |
1_555 |
9 |
2 |
9456 |
71.1 |
-1.7 |
0.453 |
0 |
0 |
0 |
0.000 |
78 |
|
[7MG]A:527 |
4 |
1 |
498 |
◊ |
L |
x,y,z |
1_555 |
13 |
4 |
9456 |
67.7 |
-0.4 |
0.519 |
1 |
0 |
0 |
0.001 |
79 |
|
N |
13 |
2 |
5730 |
◊ |
I |
x,y,z |
1_555 |
7 |
1 |
8411 |
65.5 |
-0.3 |
0.510 |
0 |
0 |
0 |
0.000 |
80 |
|
A |
8 |
2 |
211459 |
◊ |
M |
x-1/2,-y+1/2,-z-1/4 |
6_454 |
7 |
3 |
8378 |
57.3 |
-2.0 |
0.418 |
0 |
0 |
0 |
0.000 |
81 |
|
L |
5 |
2 |
9456 |
◊ |
H |
x,y,z |
1_555 |
6 |
2 |
8400 |
54.5 |
-0.9 |
0.283 |
0 |
0 |
0 |
0.000 |
82 |
|
[M2G]A:966 |
5 |
1 |
536 |
◊ |
I |
x,y,z |
1_555 |
9 |
2 |
8411 |
53.4 |
-2.0 |
0.382 |
0 |
0 |
0 |
0.004 |
83 |
|
b |
5 |
1 |
865 |
◊ |
V |
x,y,z |
1_555 |
2 |
1 |
1050 |
46.1 |
0.0 |
0.749 |
0 |
0 |
0 |
0.000 |
84 |
|
[4OC]A:1402 |
2 |
1 |
492 |
◊ |
b |
x,y,z |
1_555 |
6 |
2 |
865 |
38.6 |
-0.4 |
0.689 |
0 |
0 |
0 |
0.000 |
85 |
|
[UR3]A:1498 |
3 |
1 |
457 |
f |
[5MC]A:1404 |
x,y,z |
1_555 |
5 |
1 |
460 |
35.1 |
-0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
86 |
|
A |
4 |
2 |
211459 |
◊ |
D |
y,x,-z |
7_555 |
4 |
2 |
12136 |
34.0 |
-0.3 |
0.560 |
1 |
0 |
0 |
0.000 |
87 |
|
a |
4 |
1 |
1791 |
◊ |
K |
x,y,z |
1_555 |
3 |
1 |
7353 |
33.6 |
0.0 |
0.581 |
0 |
0 |
0 |
0.000 |
88 |
|
[5MC]A:967 |
7 |
1 |
448 |
◊ |
I |
x,y,z |
1_555 |
6 |
2 |
8411 |
32.2 |
-0.2 |
0.556 |
0 |
0 |
0 |
0.000 |
89 |
|
G |
2 |
1 |
10642 |
◊ |
G |
-y+1,-x+1,-z-1/2 |
8_664 |
2 |
1 |
10642 |
26.8 |
0.6 |
0.815 |
0 |
0 |
0 |
0.000 |
90 |
|
[MA6]A:1519 |
3 |
1 |
525 |
f |
[5MC]A:1404 |
x,y,z |
1_555 |
3 |
1 |
460 |
22.1 |
-1.4 |
0.334 |
0 |
0 |
0 |
0.005 |
91 |
|
[2MG]A:1207 |
3 |
1 |
517 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
11841 |
19.3 |
0.3 |
0.639 |
0 |
0 |
0 |
0.000 |
92 |
|
O |
2 |
1 |
6604 |
◊ |
F |
x,y,z |
1_555 |
3 |
2 |
7094 |
17.0 |
0.1 |
0.493 |
0 |
0 |
0 |
0.000 |
93 |
|
[ZN]N:101 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
211459 |
16.1 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.025 |
94 |
|
E |
2 |
1 |
8632 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
12534 |
15.6 |
0.5 |
0.757 |
0 |
0 |
0 |
0.000 |
95 |
|
[5MC]A:1400 |
1 |
1 |
448 |
f |
[M2G]A:966 |
x,y,z |
1_555 |
2 |
1 |
536 |
12.0 |
0.2 |
0.485 |
0 |
0 |
0 |
0.000 |
96 |
|
[UR3]A:1498 |
2 |
1 |
457 |
f |
[4OC]A:1402 |
x,y,z |
1_555 |
2 |
1 |
492 |
10.3 |
-0.1 |
0.466 |
0 |
0 |
0 |
0.000 |
97 |
|
[4OC]A:1402 |
3 |
1 |
492 |
◊ |
V |
x,y,z |
1_555 |
3 |
1 |
1050 |
9.8 |
-0.9 |
0.431 |
0 |
0 |
0 |
0.000 |
98 |
|
[PSU]a:40 |
3 |
1 |
450 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
7353 |
7.4 |
0.2 |
0.684 |
0 |
0 |
0 |
0.000 |
99 |
|
A |
1 |
1 |
211459 |
◊ |
K |
-y+1/2,x-1/2,z+1/4 |
3_545 |
2 |
1 |
7353 |
4.6 |
-0.3 |
0.351 |
0 |
0 |
0 |
0.000 |
100 |
|
E |
2 |
1 |
8632 |
◊ |
B |
y,x,-z |
7_555 |
1 |
1 |
12534 |
3.9 |
0.2 |
0.767 |
0 |
0 |
0 |
0.000 |
101 |
|
D |
1 |
1 |
12136 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
11841 |
3.7 |
0.3 |
0.781 |
0 |
0 |
0 |
0.000 |
102 |
|
Q |
2 |
1 |
7812 |
◊ |
O |
x,y,z |
1_555 |
1 |
1 |
6604 |
1.2 |
0.0 |
0.673 |
0 |
0 |
0 |
0.000 |
|