## |
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 |
|
D |
262 |
74 |
17919 |
◊ |
B |
x,y,z |
1_555 |
272 |
74 |
17595 |
2601.8 |
-10.9 |
0.312 |
27 |
2 |
0 |
0.554 |
2 |
|
C |
256 |
75 |
17856 |
◊ |
A |
x,y,z |
1_555 |
267 |
75 |
17665 |
2544.8 |
-11.5 |
0.277 |
25 |
2 |
0 |
0.554 |
Average: |
2573.3 |
-11.2 |
0.295 |
26 |
2 |
0 |
0.554 |
2 |
3 |
|
D |
112 |
32 |
17919 |
◊ |
A |
x,y,z |
1_555 |
113 |
31 |
17665 |
1079.5 |
-4.0 |
0.441 |
9 |
9 |
0 |
0.149 |
4 |
|
C |
113 |
32 |
17856 |
◊ |
B |
x,y,z |
1_555 |
109 |
31 |
17595 |
1056.1 |
-4.1 |
0.428 |
9 |
9 |
0 |
0.149 |
Average: |
1067.8 |
-4.0 |
0.434 |
9 |
9 |
0 |
0.149 |
3 |
5 |
|
D |
37 |
15 |
17919 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
48 |
17 |
17665 |
290.2 |
1.8 |
0.736 |
4 |
2 |
0 |
0.000 |
6 |
|
B |
45 |
15 |
17595 |
◊ |
C |
-x-3/2,-y,z-1/2 |
2_354 |
35 |
15 |
17856 |
288.3 |
2.3 |
0.761 |
4 |
2 |
0 |
0.000 |
Average: |
289.2 |
2.0 |
0.749 |
4 |
2 |
0 |
0.000 |
4 |
7 |
|
D |
22 |
6 |
17919 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
30 |
8 |
17595 |
265.7 |
0.9 |
0.515 |
4 |
2 |
0 |
0.000 |
5 |
8 |
|
C |
18 |
5 |
17856 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
18 |
7 |
17595 |
199.4 |
0.0 |
0.580 |
3 |
0 |
0 |
0.000 |
6 |
9 |
|
B |
18 |
8 |
17595 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
17665 |
183.6 |
2.5 |
0.852 |
3 |
4 |
0 |
0.000 |
10 |
|
D |
19 |
9 |
17919 |
◊ |
C |
x,y,z |
1_555 |
20 |
8 |
17856 |
180.2 |
3.2 |
0.885 |
3 |
2 |
0 |
0.000 |
Average: |
181.9 |
2.8 |
0.869 |
3 |
3 |
0 |
0.000 |
7 |
11 |
|
C |
13 |
6 |
17856 |
◊ |
D |
x-1,y,z |
1_455 |
13 |
6 |
17919 |
128.5 |
2.3 |
0.867 |
4 |
6 |
0 |
0.000 |
8 |
12 |
|
[MES]D:501 |
10 |
1 |
337 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
18 |
7 |
17665 |
126.7 |
4.2 |
0.173 |
0 |
0 |
0 |
0.000 |
9 |
13 |
|
B |
18 |
7 |
17595 |
◊ |
[MES]C:501 |
-x-3/2,-y,z-1/2 |
2_354 |
10 |
1 |
336 |
122.3 |
4.0 |
0.148 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
[MES]D:501 |
11 |
1 |
337 |
f |
D |
x,y,z |
1_555 |
18 |
9 |
17919 |
121.6 |
2.9 |
0.086 |
0 |
0 |
0 |
0.000 |
11 |
15 |
|
[MES]C:501 |
11 |
1 |
336 |
f |
C |
x,y,z |
1_555 |
17 |
8 |
17856 |
120.2 |
3.0 |
0.069 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
B |
13 |
6 |
17595 |
◊ |
D |
x-1,y,z |
1_455 |
11 |
4 |
17919 |
104.7 |
2.1 |
0.854 |
1 |
2 |
0 |
0.000 |
17 |
|
C |
10 |
5 |
17856 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
6 |
17665 |
99.4 |
1.7 |
0.807 |
2 |
2 |
0 |
0.000 |
Average: |
102.0 |
1.9 |
0.831 |
2 |
2 |
0 |
0.000 |
13 |
18 |
|
B |
10 |
3 |
17595 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
9 |
3 |
17665 |
70.4 |
0.1 |
0.605 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[CL]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
17665 |
67.2 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.209 |
20 |
|
[CL]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
17595 |
66.9 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.209 |
Average: |
67.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.209 |
15 |
21 |
|
[MN]A:501 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17665 |
64.8 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.718 |
22 |
|
[MN]C:502 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
17856 |
64.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.718 |
23 |
|
[MN]D:502 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
17919 |
64.2 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.718 |
24 |
|
[MN]B:501 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
17595 |
64.0 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.718 |
Average: |
64.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.718 |
16 |
25 |
|
C |
9 |
4 |
17856 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
7 |
6 |
17665 |
61.9 |
1.3 |
0.780 |
1 |
1 |
0 |
0.000 |
17 |
26 |
|
[CL]A:503 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
17665 |
56.4 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.111 |
18 |
27 |
|
[CL]C:503 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
17665 |
53.6 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.098 |
19 |
28 |
|
D |
3 |
1 |
17919 |
◊ |
C |
-x-1,y-1/2,-z-1/2 |
3_444 |
7 |
2 |
17856 |
47.6 |
-0.6 |
0.334 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
[CL]A:503 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
7 |
5 |
17856 |
47.3 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.087 |
21 |
30 |
|
[CL]C:503 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
17856 |
46.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.086 |
22 |
31 |
|
[CL]B:502 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
17919 |
30.3 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.093 |
32 |
|
[CL]A:502 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
17856 |
29.4 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.093 |
Average: |
29.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.093 |
23 |
33 |
|
B |
6 |
1 |
17595 |
x |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
3 |
1 |
17595 |
28.0 |
0.0 |
0.618 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
[MN]B:501 |
1 |
1 |
123 |
◊ |
D |
x,y,z |
1_555 |
5 |
4 |
17919 |
27.3 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.043 |
35 |
|
[MN]A:501 |
1 |
1 |
123 |
◊ |
C |
x,y,z |
1_555 |
5 |
4 |
17856 |
27.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.043 |
36 |
|
[MN]C:502 |
1 |
1 |
123 |
◊ |
A |
x,y,z |
1_555 |
3 |
3 |
17665 |
22.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.043 |
37 |
|
[MN]D:502 |
1 |
1 |
123 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
17595 |
21.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.043 |
Average: |
24.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.043 |
25 |
38 |
|
B |
2 |
1 |
17595 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
17665 |
11.9 |
-0.4 |
0.304 |
0 |
0 |
0 |
0.000 |
39 |
|
B |
1 |
1 |
17595 |
◊ |
A |
-x-3/2,-y,z-1/2 |
2_354 |
1 |
1 |
17665 |
3.9 |
-0.1 |
0.363 |
0 |
0 |
0 |
0.000 |
Average: |
7.9 |
-0.3 |
0.333 |
0 |
0 |
0 |
0.000 |
26 |
40 |
|
C |
1 |
1 |
17856 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
17919 |
1.9 |
0.1 |
0.780 |
0 |
0 |
0 |
0.000 |
|