## |
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 |
925 |
229 |
52368 |
◊ |
A |
x,y,z |
1_555 |
966 |
265 |
69476 |
9274.5 |
-89.2 |
0.042 |
136 |
32 |
0 |
0.658 |
2 |
|
G |
256 |
68 |
9890 |
◊ |
D |
x,y,z |
1_555 |
237 |
64 |
12432 |
2367.1 |
-21.9 |
0.090 |
27 |
10 |
0 |
1.000 |
3 |
|
E |
206 |
49 |
12600 |
◊ |
A |
x,y,z |
1_555 |
229 |
67 |
69476 |
2115.0 |
-14.9 |
0.297 |
26 |
8 |
0 |
0.223 |
4 |
|
K |
190 |
46 |
8697 |
◊ |
C |
x,y,z |
1_555 |
204 |
53 |
16131 |
2107.8 |
-32.5 |
0.047 |
18 |
11 |
0 |
1.000 |
5 |
|
F |
210 |
55 |
5620 |
◊ |
A |
x,y,z |
1_555 |
224 |
52 |
69476 |
1935.9 |
-19.7 |
0.296 |
26 |
10 |
0 |
0.264 |
6 |
|
C |
187 |
46 |
16131 |
◊ |
B |
x,y,z |
1_555 |
183 |
44 |
52368 |
1702.7 |
-7.4 |
0.655 |
30 |
10 |
0 |
0.323 |
7 |
|
J |
156 |
33 |
4997 |
◊ |
B |
x,y,z |
1_555 |
189 |
56 |
52368 |
1602.8 |
-16.5 |
0.301 |
19 |
4 |
0 |
0.779 |
8 |
|
I |
167 |
43 |
9248 |
◊ |
A |
x,y,z |
1_555 |
178 |
48 |
69476 |
1598.3 |
-14.2 |
0.281 |
23 |
5 |
0 |
0.202 |
9 |
|
H |
159 |
39 |
8270 |
◊ |
A |
x,y,z |
1_555 |
149 |
46 |
69476 |
1436.5 |
-16.8 |
0.085 |
23 |
5 |
0 |
0.224 |
10 |
|
I |
157 |
37 |
9248 |
◊ |
B |
x,y,z |
1_555 |
145 |
37 |
52368 |
1388.4 |
-15.8 |
0.171 |
9 |
2 |
0 |
0.065 |
11 |
|
J |
111 |
28 |
4997 |
◊ |
C |
x,y,z |
1_555 |
125 |
37 |
16131 |
1158.1 |
-3.9 |
0.729 |
19 |
10 |
0 |
1.000 |
12 |
|
L |
101 |
23 |
4480 |
◊ |
B |
x,y,z |
1_555 |
118 |
36 |
52368 |
1090.8 |
-1.5 |
0.724 |
20 |
15 |
0 |
0.093 |
13 |
|
K |
101 |
24 |
8697 |
◊ |
A |
x,y,z |
1_555 |
107 |
27 |
69476 |
995.6 |
-10.0 |
0.356 |
11 |
2 |
0 |
0.062 |
14 |
|
G |
83 |
24 |
9890 |
◊ |
G |
-x+1,y,-z-1/2 |
3_654 |
82 |
24 |
9890 |
766.4 |
-6.9 |
0.362 |
2 |
0 |
0 |
0.000 |
15 |
|
T |
82 |
9 |
4201 |
◊ |
A |
x,y,z |
1_555 |
81 |
23 |
69476 |
669.8 |
-6.7 |
0.720 |
7 |
0 |
0 |
0.042 |
16 |
|
G |
66 |
16 |
9890 |
◊ |
A |
x,y,z |
1_555 |
57 |
16 |
69476 |
588.7 |
-8.5 |
0.122 |
7 |
4 |
0 |
0.068 |
17 |
|
L |
50 |
10 |
4480 |
◊ |
C |
x,y,z |
1_555 |
79 |
21 |
16131 |
552.8 |
-2.4 |
0.567 |
9 |
4 |
0 |
0.051 |
18 |
|
I |
63 |
15 |
9248 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
52 |
16 |
69476 |
497.7 |
0.2 |
0.550 |
10 |
2 |
0 |
0.000 |
19 |
|
G |
52 |
13 |
9890 |
◊ |
F |
x,y,z |
1_555 |
48 |
16 |
5620 |
482.8 |
-3.3 |
0.547 |
2 |
1 |
0 |
0.024 |
20 |
|
K |
42 |
14 |
8697 |
◊ |
B |
x,y,z |
1_555 |
54 |
18 |
52368 |
471.7 |
-1.3 |
0.711 |
6 |
4 |
0 |
0.040 |
21 |
|
T |
54 |
10 |
4201 |
◊ |
N |
x,y,z |
1_555 |
49 |
9 |
2297 |
463.9 |
-4.4 |
0.691 |
25 |
0 |
0 |
1.000 |
22 |
|
D |
32 |
7 |
12432 |
◊ |
B |
x,y,z |
1_555 |
46 |
12 |
52368 |
368.1 |
0.5 |
0.709 |
3 |
2 |
0 |
0.002 |
23 |
|
C |
38 |
10 |
16131 |
◊ |
A |
x,-y,-z |
4_555 |
42 |
9 |
69476 |
357.6 |
-0.7 |
0.683 |
6 |
1 |
0 |
0.000 |
24 |
|
T |
39 |
6 |
4201 |
◊ |
B |
x,y,z |
1_555 |
48 |
20 |
52368 |
348.5 |
-7.8 |
0.402 |
10 |
0 |
0 |
0.052 |
25 |
|
C |
39 |
10 |
16131 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
69476 |
341.4 |
-1.3 |
0.634 |
4 |
0 |
0 |
0.010 |
26 |
|
N |
32 |
6 |
2297 |
◊ |
A |
x,y,z |
1_555 |
35 |
16 |
69476 |
318.8 |
-4.6 |
0.383 |
4 |
0 |
0 |
0.024 |
27 |
|
D |
35 |
12 |
12432 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
37 |
11 |
69476 |
313.6 |
1.3 |
0.771 |
4 |
7 |
0 |
0.000 |
28 |
|
D |
23 |
5 |
12432 |
◊ |
A |
x,y,z |
1_555 |
27 |
12 |
69476 |
262.1 |
-1.6 |
0.457 |
3 |
3 |
0 |
0.019 |
29 |
|
P |
25 |
4 |
1198 |
◊ |
B |
x,y,z |
1_555 |
35 |
17 |
52368 |
259.2 |
-7.3 |
0.275 |
3 |
0 |
0 |
0.037 |
30 |
|
[APC]A:2455 |
25 |
1 |
634 |
◊ |
A |
x,y,z |
1_555 |
22 |
10 |
69476 |
222.7 |
0.8 |
0.767 |
1 |
0 |
0 |
0.000 |
31 |
|
P |
27 |
4 |
1198 |
◊ |
T |
x,y,z |
1_555 |
25 |
5 |
4201 |
202.9 |
1.2 |
0.767 |
7 |
0 |
0 |
0.008 |
32 |
|
[BRU]T:22 |
20 |
1 |
445 |
cf |
T |
x,y,z |
1_555 |
31 |
2 |
4201 |
201.0 |
3.5 |
0.730 |
0 |
0 |
0 |
0.000 |
33 |
|
K |
21 |
7 |
8697 |
◊ |
H |
x,y,z |
1_555 |
20 |
6 |
8270 |
197.1 |
-1.5 |
0.513 |
1 |
0 |
0 |
0.005 |
34 |
|
F |
19 |
7 |
5620 |
◊ |
E |
x,y,z |
1_555 |
16 |
4 |
12600 |
155.0 |
0.8 |
0.654 |
2 |
2 |
0 |
0.003 |
35 |
|
H |
16 |
5 |
8270 |
◊ |
C |
x,y,z |
1_555 |
22 |
5 |
16131 |
149.6 |
-2.0 |
0.395 |
0 |
0 |
0 |
0.006 |
36 |
|
[APC]A:2455 |
10 |
1 |
634 |
f |
B |
x,y,z |
1_555 |
21 |
6 |
52368 |
143.8 |
-2.4 |
0.356 |
5 |
0 |
0 |
0.140 |
37 |
|
P |
14 |
2 |
1198 |
◊ |
A |
x,y,z |
1_555 |
25 |
9 |
69476 |
124.6 |
-0.1 |
0.703 |
1 |
0 |
0 |
0.002 |
38 |
|
G |
12 |
5 |
9890 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
52368 |
107.8 |
-2.5 |
0.217 |
0 |
0 |
0 |
0.011 |
39 |
|
[APC]A:2455 |
17 |
1 |
634 |
◊ |
P |
x,y,z |
1_555 |
16 |
1 |
1198 |
102.3 |
2.4 |
0.812 |
0 |
0 |
0 |
0.000 |
40 |
|
[BRU]T:22 |
8 |
1 |
445 |
◊ |
B |
x,y,z |
1_555 |
20 |
9 |
52368 |
99.4 |
-2.4 |
0.307 |
1 |
0 |
0 |
0.012 |
41 |
|
F |
12 |
5 |
5620 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
52368 |
92.1 |
-0.1 |
0.665 |
1 |
0 |
0 |
0.002 |
42 |
|
[BRU]T:22 |
10 |
1 |
445 |
◊ |
P |
x,y,z |
1_555 |
10 |
2 |
1198 |
79.8 |
1.5 |
0.642 |
1 |
0 |
0 |
0.000 |
43 |
|
L |
10 |
4 |
4480 |
◊ |
B |
x,-y,-z |
4_555 |
11 |
4 |
52368 |
77.9 |
-0.5 |
0.537 |
1 |
0 |
0 |
0.000 |
44 |
|
E |
6 |
2 |
12600 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
52368 |
65.9 |
-0.4 |
0.491 |
0 |
0 |
0 |
0.001 |
45 |
|
L |
8 |
5 |
4480 |
◊ |
J |
x,y,z |
1_555 |
5 |
2 |
4997 |
65.3 |
-0.7 |
0.287 |
0 |
0 |
0 |
0.005 |
46 |
|
L |
7 |
3 |
4480 |
◊ |
L |
x,-y,-z |
4_555 |
7 |
3 |
4480 |
64.2 |
1.3 |
0.801 |
0 |
0 |
0 |
0.000 |
47 |
|
[APC]A:2455 |
4 |
1 |
634 |
◊ |
T |
x,y,z |
1_555 |
8 |
2 |
4201 |
60.0 |
-0.5 |
0.527 |
2 |
0 |
0 |
0.006 |
48 |
|
C |
7 |
3 |
16131 |
◊ |
B |
x,-y,-z |
4_555 |
5 |
3 |
52368 |
38.0 |
-0.0 |
0.602 |
0 |
0 |
0 |
0.000 |
49 |
|
[MG]A:2458 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
69476 |
34.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.042 |
50 |
|
[MG]A:2458 |
1 |
1 |
98 |
◊ |
P |
x,y,z |
1_555 |
3 |
1 |
1198 |
25.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.014 |
51 |
|
L |
2 |
1 |
4480 |
◊ |
K |
x,y,z |
1_555 |
4 |
2 |
8697 |
25.8 |
0.2 |
0.608 |
0 |
0 |
0 |
0.000 |
52 |
|
[BRU]T:22 |
3 |
1 |
445 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
69476 |
23.5 |
-0.4 |
0.448 |
0 |
0 |
0 |
0.002 |
53 |
|
[MG]A:2458 |
1 |
1 |
98 |
◊ |
[APC]A:2455 |
x,y,z |
1_555 |
4 |
1 |
634 |
21.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.008 |
54 |
|
B |
3 |
1 |
52368 |
◊ |
B |
x,-y,-z |
4_555 |
3 |
1 |
52368 |
14.8 |
0.2 |
0.730 |
0 |
0 |
0 |
0.000 |
55 |
|
[ZN]C:1269 |
1 |
1 |
98 |
f |
A |
x,-y,-z |
4_555 |
1 |
1 |
69476 |
12.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.039 |
56 |
|
G |
1 |
1 |
9890 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
2 |
1 |
52368 |
5.7 |
0.1 |
0.674 |
0 |
0 |
0 |
0.000 |
57 |
|
[ZN]J:1066 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
52368 |
4.9 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.065 |
58 |
|
H |
1 |
1 |
8270 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
52368 |
1.5 |
0.0 |
0.601 |
0 |
0 |
0 |
0.000 |
59 |
|
[ZN]B:2225 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
69476 |
1.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.004 |
60 |
|
[ZN]A:2457 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
52368 |
1.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.017 |
|