## |
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 |
|
C |
220 |
61 |
16985 |
◊ |
B |
x,y,z |
1_555 |
221 |
65 |
17035 |
2168.1 |
-32.4 |
0.203 |
18 |
5 |
0 |
0.628 |
2 |
|
B |
219 |
62 |
17035 |
◊ |
A |
x,y,z |
1_555 |
216 |
66 |
17061 |
2167.4 |
-32.6 |
0.188 |
21 |
6 |
0 |
0.628 |
3 |
|
D |
221 |
60 |
17003 |
◊ |
C |
x,y,z |
1_555 |
211 |
63 |
16985 |
2130.6 |
-31.7 |
0.209 |
22 |
6 |
0 |
0.628 |
4 |
|
E |
209 |
62 |
16928 |
◊ |
A |
x,y,z |
1_555 |
215 |
60 |
17061 |
2120.6 |
-32.4 |
0.169 |
19 |
5 |
0 |
0.628 |
5 |
|
E |
219 |
61 |
16928 |
◊ |
D |
x,y,z |
1_555 |
212 |
64 |
17003 |
2117.4 |
-30.6 |
0.241 |
19 |
6 |
0 |
0.628 |
Average: |
2140.8 |
-31.9 |
0.202 |
20 |
6 |
0 |
0.628 |
2 |
6 |
|
B |
61 |
18 |
17035 |
◊ |
B |
-x,y,-z |
2_555 |
61 |
18 |
17035 |
507.3 |
-5.8 |
0.608 |
4 |
6 |
0 |
0.000 |
3 |
7 |
|
[PLC]D:402 |
33 |
1 |
837 |
f |
D |
x,y,z |
1_555 |
49 |
17 |
17003 |
394.1 |
-1.7 |
0.432 |
2 |
0 |
0 |
0.037 |
8 |
|
[PLC]A:402 |
33 |
1 |
834 |
f |
A |
x,y,z |
1_555 |
48 |
16 |
17061 |
393.7 |
-1.6 |
0.429 |
2 |
0 |
0 |
0.037 |
9 |
|
[PLC]C:402 |
33 |
1 |
837 |
f |
C |
x,y,z |
1_555 |
47 |
17 |
16985 |
393.0 |
-1.6 |
0.409 |
2 |
0 |
0 |
0.037 |
10 |
|
[PLC]E:402 |
33 |
1 |
838 |
f |
E |
x,y,z |
1_555 |
45 |
16 |
16928 |
391.3 |
-1.5 |
0.408 |
2 |
0 |
0 |
0.037 |
11 |
|
[PLC]B:402 |
33 |
1 |
837 |
f |
B |
x,y,z |
1_555 |
46 |
16 |
17035 |
391.1 |
-1.4 |
0.417 |
2 |
0 |
0 |
0.037 |
Average: |
392.6 |
-1.6 |
0.419 |
2 |
0 |
0 |
0.037 |
4 |
12 |
|
D |
37 |
13 |
17003 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
35 |
13 |
17061 |
317.7 |
-1.5 |
0.770 |
4 |
0 |
0 |
0.000 |
5 |
13 |
|
C |
20 |
10 |
16985 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
23 |
11 |
16928 |
181.7 |
0.8 |
0.872 |
0 |
0 |
0 |
0.000 |
6 |
14 |
|
[LMT]D:403 |
11 |
1 |
439 |
f |
E |
x,y,z |
1_555 |
5 |
4 |
16928 |
90.3 |
-0.5 |
0.007 |
0 |
0 |
0 |
0.002 |
7 |
15 |
|
[LMT]D:403 |
11 |
1 |
439 |
◊ |
D |
x,y,z |
1_555 |
6 |
4 |
17003 |
89.8 |
-0.1 |
0.013 |
0 |
0 |
0 |
0.000 |
8 |
16 |
|
[LMT]D:403 |
9 |
1 |
439 |
◊ |
C |
x,y,z |
1_555 |
5 |
4 |
16985 |
89.6 |
0.1 |
0.014 |
0 |
0 |
0 |
0.000 |
9 |
17 |
|
[LMT]D:403 |
8 |
1 |
439 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
17061 |
89.4 |
-0.3 |
0.019 |
0 |
0 |
0 |
0.000 |
10 |
18 |
|
A |
11 |
2 |
17061 |
◊ |
A |
-x,y,-z |
2_555 |
10 |
2 |
17061 |
87.9 |
-0.1 |
0.753 |
0 |
0 |
0 |
0.000 |
11 |
19 |
|
D |
11 |
4 |
17003 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
12 |
4 |
16985 |
87.1 |
-1.9 |
0.395 |
0 |
0 |
0 |
0.000 |
20 |
|
E |
10 |
3 |
16928 |
◊ |
B |
-x+1,y,-z+1 |
2_656 |
9 |
3 |
17035 |
82.7 |
-1.9 |
0.341 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
9 |
3 |
17061 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
9 |
3 |
17061 |
79.8 |
-1.8 |
0.336 |
0 |
0 |
0 |
0.000 |
Average: |
83.2 |
-1.8 |
0.357 |
0 |
0 |
0 |
0.000 |
12 |
22 |
|
[LMT]D:403 |
12 |
1 |
439 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
17035 |
84.4 |
0.0 |
0.014 |
0 |
0 |
0 |
0.000 |
13 |
23 |
|
[CL]D:401 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
17003 |
78.8 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.167 |
24 |
|
[CL]A:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
17061 |
78.1 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.167 |
25 |
|
[CL]B:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
17035 |
77.5 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.167 |
26 |
|
[CL]C:401 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
16985 |
77.3 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.167 |
27 |
|
[CL]E:401 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
10 |
4 |
16928 |
76.4 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.167 |
Average: |
77.6 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.167 |
14 |
28 |
|
[NA]C:403 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
16 |
9 |
16985 |
76.1 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.150 |
29 |
|
[NA]D:404 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
9 |
17003 |
75.7 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.150 |
30 |
|
[NA]B:403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
15 |
9 |
17035 |
75.4 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.150 |
31 |
|
[NA]A:405 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
9 |
17061 |
75.2 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.150 |
32 |
|
[NA]E:403 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
13 |
9 |
16928 |
74.9 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.150 |
Average: |
75.4 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.150 |
15 |
33 |
|
[NA]A:403 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
17035 |
26.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.034 |
34 |
|
[NA]A:403 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
16985 |
23.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.034 |
35 |
|
[NA]A:403 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
17061 |
23.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.034 |
36 |
|
[NA]A:403 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
3 |
2 |
16928 |
19.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.034 |
37 |
|
[NA]A:403 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
17003 |
16.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
21.8 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.034 |
16 |
38 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
17061 |
26.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.033 |
39 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
16928 |
25.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.033 |
40 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
17035 |
21.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.033 |
41 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
17003 |
17.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.033 |
42 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
16985 |
16.7 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.033 |
Average: |
21.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.033 |
17 |
43 |
|
[CL]C:401 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
17035 |
22.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.017 |
44 |
|
[CL]E:401 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
17003 |
14.2 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.017 |
45 |
|
[CL]A:401 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
16928 |
10.4 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.017 |
46 |
|
[CL]B:401 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
17061 |
8.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.017 |
47 |
|
[CL]D:401 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
16985 |
5.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
12.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.017 |
18 |
48 |
|
C |
2 |
1 |
16985 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
17061 |
10.7 |
0.1 |
0.741 |
0 |
0 |
0 |
0.000 |
49 |
|
D |
2 |
1 |
17003 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
16928 |
2.2 |
0.0 |
0.697 |
0 |
0 |
0 |
0.000 |
Average: |
6.5 |
0.0 |
0.719 |
0 |
0 |
0 |
0.000 |
19 |
50 |
|
B |
1 |
1 |
17035 |
◊ |
A |
-x,y,-z |
2_555 |
1 |
1 |
17061 |
3.9 |
0.1 |
0.825 |
0 |
0 |
0 |
0.000 |
20 |
51 |
|
C |
1 |
1 |
16985 |
◊ |
[PLC]E:402 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
838 |
1.4 |
0.1 |
0.617 |
0 |
0 |
0 |
0.000 |
|