| ## |
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 |
902 |
241 |
76958 |
◊ |
C |
x,y,z |
1_555 |
832 |
217 |
54997 |
8510.3 |
-98.4 |
0.000 |
96 |
28 |
0 |
0.941 |
2 |
|
J |
902 |
242 |
70800 |
◊ |
I |
x,y,z |
1_555 |
826 |
215 |
54957 |
8479.7 |
-97.1 |
0.000 |
97 |
25 |
0 |
0.941 |
| Average: |
8495.0 |
-97.7 |
0.000 |
97 |
27 |
0 |
0.941 |
| 2 |
3 |
|
L |
404 |
111 |
24308 |
◊ |
J |
x,y,z |
1_555 |
409 |
117 |
70800 |
3854.7 |
-17.0 |
0.453 |
41 |
26 |
0 |
0.806 |
4 |
|
F |
408 |
112 |
24324 |
◊ |
D |
x,y,z |
1_555 |
410 |
116 |
76958 |
3786.0 |
-16.6 |
0.459 |
36 |
23 |
0 |
0.806 |
| Average: |
3820.3 |
-16.8 |
0.456 |
39 |
25 |
0 |
0.806 |
| 3 |
5 |
|
K |
227 |
59 |
7324 |
◊ |
J |
x,y,z |
1_555 |
226 |
60 |
70800 |
2242.3 |
-22.9 |
0.092 |
27 |
6 |
0 |
0.795 |
6 |
|
E |
225 |
59 |
7310 |
◊ |
D |
x,y,z |
1_555 |
229 |
60 |
76958 |
2239.4 |
-22.7 |
0.092 |
27 |
6 |
0 |
0.795 |
| Average: |
2240.8 |
-22.8 |
0.092 |
27 |
6 |
0 |
0.795 |
| 4 |
7 |
|
L |
232 |
67 |
24308 |
◊ |
I |
x,y,z |
1_555 |
259 |
67 |
54957 |
2234.6 |
-22.2 |
0.127 |
12 |
6 |
0 |
1.000 |
8 |
|
F |
225 |
63 |
24324 |
◊ |
C |
x,y,z |
1_555 |
249 |
65 |
54997 |
2191.6 |
-22.0 |
0.120 |
12 |
6 |
0 |
1.000 |
| Average: |
2213.1 |
-22.1 |
0.123 |
12 |
6 |
0 |
1.000 |
| 5 |
9 |
|
I |
230 |
63 |
54957 |
◊ |
G |
x,y,z |
1_555 |
213 |
59 |
13425 |
2080.5 |
-4.3 |
0.733 |
28 |
14 |
0 |
1.000 |
10 |
|
C |
227 |
63 |
54997 |
◊ |
A |
x,y,z |
1_555 |
210 |
58 |
13430 |
2053.6 |
-4.0 |
0.740 |
26 |
13 |
0 |
1.000 |
| Average: |
2067.0 |
-4.2 |
0.737 |
27 |
14 |
0 |
1.000 |
| 6 |
11 |
|
B |
186 |
53 |
13419 |
◊ |
A |
x,y,z |
1_555 |
197 |
50 |
13430 |
1885.4 |
-27.4 |
0.032 |
12 |
0 |
0 |
1.000 |
12 |
|
H |
188 |
53 |
13419 |
◊ |
G |
x,y,z |
1_555 |
199 |
51 |
13425 |
1885.0 |
-27.3 |
0.035 |
12 |
0 |
0 |
1.000 |
| Average: |
1885.2 |
-27.3 |
0.034 |
12 |
0 |
0 |
1.000 |
| 7 |
13 |
|
O |
136 |
18 |
7098 |
◊ |
F |
x,y,z |
1_555 |
165 |
40 |
24324 |
1405.0 |
-11.0 |
0.649 |
17 |
0 |
0 |
1.000 |
14 |
|
R |
137 |
18 |
7084 |
◊ |
L |
x,y,z |
1_555 |
163 |
40 |
24308 |
1391.5 |
-11.3 |
0.646 |
18 |
0 |
0 |
1.000 |
| Average: |
1398.3 |
-11.2 |
0.648 |
18 |
0 |
0 |
1.000 |
| 8 |
15 |
|
J |
147 |
38 |
70800 |
◊ |
D |
x,y,z |
1_555 |
149 |
40 |
76958 |
1382.8 |
-14.6 |
0.087 |
6 |
6 |
0 |
0.494 |
| 9 |
16 |
|
J |
136 |
35 |
70800 |
◊ |
H |
x,y,z |
1_555 |
143 |
39 |
13419 |
1304.3 |
-7.3 |
0.328 |
13 |
13 |
0 |
0.418 |
17 |
|
D |
137 |
35 |
76958 |
◊ |
B |
x,y,z |
1_555 |
140 |
37 |
13419 |
1260.7 |
-6.5 |
0.357 |
13 |
14 |
0 |
0.418 |
| Average: |
1282.5 |
-6.9 |
0.342 |
13 |
14 |
0 |
0.418 |
| 10 |
18 |
|
P |
119 |
25 |
5753 |
◊ |
O |
x,y,z |
1_555 |
125 |
25 |
7098 |
1137.1 |
-11.6 |
0.804 |
61 |
0 |
0 |
1.000 |
19 |
|
S |
119 |
25 |
5737 |
◊ |
R |
x,y,z |
1_555 |
124 |
25 |
7084 |
1129.8 |
-11.4 |
0.801 |
60 |
0 |
0 |
1.000 |
| Average: |
1133.4 |
-11.5 |
0.803 |
61 |
0 |
0 |
1.000 |
| 11 |
20 |
|
D |
68 |
22 |
76958 |
◊ |
D |
-y,-x,-z+1/2 |
8_555 |
67 |
21 |
76958 |
698.7 |
0.3 |
0.643 |
8 |
2 |
0 |
0.000 |
| 12 |
21 |
|
S |
57 |
12 |
5737 |
◊ |
L |
x,y,z |
1_555 |
57 |
18 |
24308 |
507.4 |
-4.4 |
0.612 |
5 |
0 |
0 |
0.103 |
22 |
|
P |
57 |
12 |
5753 |
◊ |
F |
x,y,z |
1_555 |
54 |
19 |
24324 |
491.0 |
-3.9 |
0.634 |
4 |
0 |
0 |
0.103 |
| Average: |
499.2 |
-4.1 |
0.623 |
5 |
0 |
0 |
0.103 |
| 13 |
23 |
|
J |
41 |
13 |
70800 |
◊ |
H |
-y+1/2,x+1/2,z-1/4 |
3_554 |
49 |
15 |
13419 |
381.2 |
-0.9 |
0.540 |
4 |
1 |
0 |
0.000 |
24 |
|
B |
34 |
10 |
13419 |
◊ |
D |
-y+1/2,x+1/2,z-1/4 |
3_554 |
29 |
9 |
76958 |
274.9 |
-0.7 |
0.450 |
2 |
0 |
0 |
0.000 |
| Average: |
328.1 |
-0.8 |
0.495 |
3 |
1 |
0 |
0.000 |
| 14 |
25 |
|
A |
34 |
8 |
13430 |
◊ |
D |
-y+1/2,x+1/2,z-1/4 |
3_554 |
35 |
11 |
76958 |
329.2 |
0.9 |
0.709 |
4 |
2 |
0 |
0.000 |
| 15 |
26 |
|
I |
27 |
9 |
54957 |
◊ |
H |
x,y,z |
1_555 |
28 |
9 |
13419 |
221.5 |
-0.3 |
0.626 |
1 |
1 |
0 |
0.018 |
27 |
|
C |
27 |
9 |
54997 |
◊ |
B |
x,y,z |
1_555 |
26 |
8 |
13419 |
216.7 |
-0.3 |
0.617 |
1 |
1 |
0 |
0.018 |
| Average: |
219.1 |
-0.3 |
0.622 |
1 |
1 |
0 |
0.018 |
| 16 |
28 |
|
S |
22 |
2 |
5737 |
◊ |
L |
-y+1,-x+1,-z+1/2 |
8_665 |
13 |
4 |
24308 |
143.8 |
0.1 |
0.716 |
2 |
0 |
0 |
0.000 |
| 17 |
29 |
|
I |
14 |
3 |
54957 |
◊ |
C |
-y+1/2,x+1/2,z-1/4 |
3_554 |
13 |
3 |
54997 |
120.6 |
0.4 |
0.691 |
0 |
0 |
0 |
0.000 |
| 18 |
30 |
|
K |
10 |
3 |
7324 |
◊ |
I |
x,y,z |
1_555 |
16 |
6 |
54957 |
114.9 |
-0.3 |
0.575 |
2 |
0 |
0 |
0.005 |
31 |
|
E |
10 |
3 |
7310 |
◊ |
C |
x,y,z |
1_555 |
16 |
6 |
54997 |
111.9 |
-0.4 |
0.570 |
2 |
0 |
0 |
0.005 |
| Average: |
113.4 |
-0.3 |
0.573 |
2 |
0 |
0 |
0.005 |
| 19 |
32 |
|
D |
8 |
3 |
76958 |
◊ |
H |
x,y,z |
1_555 |
18 |
4 |
13419 |
108.3 |
-2.3 |
0.157 |
0 |
0 |
0 |
0.058 |
33 |
|
J |
7 |
3 |
70800 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
13419 |
70.4 |
-1.8 |
0.218 |
0 |
0 |
0 |
0.058 |
| Average: |
89.4 |
-2.0 |
0.187 |
0 |
0 |
0 |
0.058 |
| 20 |
34 |
|
S |
11 |
1 |
5737 |
◊ |
R |
-y+1,-x+1,-z+1/2 |
8_665 |
11 |
1 |
7084 |
74.0 |
2.4 |
0.846 |
0 |
0 |
0 |
0.000 |
| 21 |
35 |
|
D |
11 |
3 |
76958 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
13430 |
73.0 |
1.2 |
0.757 |
1 |
0 |
0 |
0.000 |
36 |
|
J |
10 |
3 |
70800 |
◊ |
G |
x,y,z |
1_555 |
7 |
1 |
13425 |
70.3 |
1.1 |
0.741 |
1 |
0 |
0 |
0.000 |
| Average: |
71.6 |
1.2 |
0.749 |
1 |
0 |
0 |
0.000 |
| 22 |
37 |
|
R |
11 |
2 |
7084 |
◊ |
R |
-y+1,-x+1,-z+1/2 |
8_665 |
11 |
2 |
7084 |
58.1 |
1.2 |
0.772 |
0 |
0 |
0 |
0.000 |
| 23 |
38 |
|
[MG]J:2003 |
1 |
1 |
98 |
f |
J |
x,y,z |
1_555 |
5 |
3 |
70800 |
49.7 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.506 |
39 |
|
[MG]D:2003 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
76958 |
49.5 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.506 |
| Average: |
49.6 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.506 |
| 24 |
40 |
|
K |
4 |
2 |
7324 |
◊ |
H |
x,y,z |
1_555 |
6 |
4 |
13419 |
44.9 |
-1.0 |
0.309 |
0 |
0 |
0 |
0.003 |
41 |
|
E |
4 |
2 |
7310 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
13419 |
42.7 |
-1.0 |
0.318 |
0 |
0 |
0 |
0.003 |
| Average: |
43.8 |
-1.0 |
0.314 |
0 |
0 |
0 |
0.003 |
| 25 |
42 |
|
R |
5 |
1 |
7084 |
◊ |
J |
x,y,z |
1_555 |
4 |
2 |
70800 |
44.7 |
-1.4 |
0.422 |
1 |
0 |
0 |
0.012 |
43 |
|
O |
5 |
1 |
7098 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
76958 |
44.2 |
-1.4 |
0.432 |
1 |
0 |
0 |
0.012 |
| Average: |
44.4 |
-1.4 |
0.427 |
1 |
0 |
0 |
0.012 |
| 26 |
44 |
|
F |
7 |
3 |
24324 |
◊ |
F |
-y,-x,-z+1/2 |
8_555 |
7 |
3 |
24324 |
40.5 |
1.8 |
0.871 |
0 |
0 |
0 |
0.000 |
| 27 |
45 |
|
O |
3 |
1 |
7098 |
◊ |
D |
-y,-x,-z+1/2 |
8_555 |
3 |
2 |
76958 |
33.8 |
-2.0 |
0.180 |
0 |
0 |
0 |
0.000 |
| 28 |
46 |
|
R |
1 |
1 |
7084 |
◊ |
L |
-y+1,-x+1,-z+1/2 |
8_665 |
1 |
1 |
24308 |
17.8 |
1.0 |
0.886 |
0 |
0 |
0 |
0.000 |
| 29 |
47 |
|
P |
1 |
1 |
5753 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
76958 |
9.4 |
-0.7 |
0.201 |
0 |
0 |
0 |
0.005 |
48 |
|
S |
2 |
1 |
5737 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
70800 |
7.0 |
-0.5 |
0.295 |
0 |
0 |
0 |
0.005 |
| Average: |
8.2 |
-0.6 |
0.248 |
0 |
0 |
0 |
0.005 |
| 30 |
49 |
|
D |
1 |
1 |
76958 |
x |
D |
-y+1/2,x+1/2,z-1/4 |
3_554 |
1 |
1 |
76958 |
0.3 |
-0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
|