## |
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 |
|
B |
157 |
37 |
6312 |
◊ |
A |
x,y,z |
1_555 |
171 |
36 |
6324 |
1431.4 |
-23.2 |
0.318 |
10 |
9 |
0 |
0.897 |
2 |
|
H |
147 |
35 |
6210 |
◊ |
G |
x,y,z |
1_555 |
156 |
36 |
6124 |
1332.2 |
-28.1 |
0.192 |
5 |
4 |
0 |
0.897 |
Average: |
1381.8 |
-25.7 |
0.255 |
8 |
7 |
0 |
0.897 |
2 |
3 |
|
C |
154 |
40 |
7043 |
◊ |
B |
x,y,z |
1_555 |
146 |
37 |
6312 |
1419.1 |
-27.2 |
0.264 |
10 |
6 |
0 |
1.000 |
4 |
|
I |
149 |
37 |
7021 |
◊ |
H |
x,y,z |
1_555 |
143 |
36 |
6210 |
1390.3 |
-29.9 |
0.240 |
7 |
9 |
0 |
1.000 |
Average: |
1404.7 |
-28.5 |
0.252 |
9 |
8 |
0 |
1.000 |
3 |
5 |
|
J |
139 |
33 |
6366 |
◊ |
I |
x,y,z |
1_555 |
147 |
37 |
7021 |
1364.0 |
-22.0 |
0.250 |
8 |
2 |
0 |
1.000 |
6 |
|
D |
127 |
32 |
6143 |
◊ |
C |
x,y,z |
1_555 |
141 |
37 |
7043 |
1324.1 |
-20.4 |
0.197 |
12 |
13 |
0 |
1.000 |
Average: |
1344.0 |
-21.2 |
0.223 |
10 |
8 |
0 |
1.000 |
4 |
7 |
|
D |
144 |
36 |
6143 |
◊ |
A |
x,y,z |
1_555 |
145 |
35 |
6324 |
1326.1 |
-21.0 |
0.138 |
11 |
5 |
0 |
0.810 |
8 |
|
J |
130 |
33 |
6366 |
◊ |
G |
x,y,z |
1_555 |
136 |
32 |
6124 |
1228.7 |
-18.6 |
0.199 |
9 |
7 |
0 |
0.810 |
Average: |
1277.4 |
-19.8 |
0.168 |
10 |
6 |
0 |
0.810 |
5 |
9 |
|
F |
79 |
22 |
14429 |
x |
F |
x-1/2,-y-1/2,-z |
4_445 |
92 |
25 |
14429 |
788.6 |
-0.3 |
0.688 |
10 |
3 |
0 |
0.000 |
6 |
10 |
|
E |
60 |
18 |
15344 |
◊ |
K |
-x,y-1/2,-z-1/2 |
3_544 |
52 |
17 |
15127 |
487.7 |
0.4 |
0.727 |
3 |
1 |
0 |
0.000 |
11 |
|
E |
49 |
15 |
15344 |
◊ |
K |
-x+1,y-1/2,-z-1/2 |
3_644 |
53 |
15 |
15127 |
462.0 |
0.6 |
0.745 |
6 |
4 |
0 |
0.000 |
Average: |
474.8 |
0.5 |
0.736 |
5 |
3 |
0 |
0.000 |
7 |
12 |
|
E |
57 |
18 |
15344 |
◊ |
C |
x,y,z |
1_555 |
44 |
12 |
7043 |
483.7 |
-3.7 |
0.558 |
2 |
4 |
0 |
0.032 |
13 |
|
K |
48 |
16 |
15127 |
◊ |
I |
x,y,z |
1_555 |
38 |
10 |
7021 |
443.5 |
-2.4 |
0.652 |
2 |
5 |
0 |
0.032 |
Average: |
463.6 |
-3.1 |
0.605 |
2 |
5 |
0 |
0.032 |
8 |
14 |
|
I |
31 |
15 |
7021 |
◊ |
G |
x,y,z |
1_555 |
38 |
14 |
6124 |
306.6 |
-8.2 |
0.106 |
1 |
0 |
0 |
0.136 |
15 |
|
C |
31 |
14 |
7043 |
◊ |
A |
x,y,z |
1_555 |
24 |
11 |
6324 |
255.1 |
-6.8 |
0.125 |
1 |
0 |
0 |
0.136 |
Average: |
280.8 |
-7.5 |
0.115 |
1 |
0 |
0 |
0.136 |
9 |
16 |
|
D |
34 |
15 |
6143 |
◊ |
B |
x,y,z |
1_555 |
30 |
13 |
6312 |
302.9 |
-8.8 |
0.071 |
1 |
1 |
0 |
0.122 |
17 |
|
J |
28 |
13 |
6366 |
◊ |
H |
x,y,z |
1_555 |
25 |
11 |
6210 |
240.4 |
-8.4 |
0.061 |
0 |
0 |
0 |
0.122 |
Average: |
271.6 |
-8.6 |
0.066 |
1 |
1 |
0 |
0.122 |
10 |
18 |
|
E |
42 |
12 |
15344 |
◊ |
I |
x,y-1,z |
1_545 |
20 |
6 |
7021 |
298.7 |
-5.9 |
0.150 |
1 |
0 |
0 |
0.042 |
19 |
|
C |
20 |
6 |
7043 |
◊ |
K |
x,y-1,z |
1_545 |
31 |
10 |
15127 |
262.1 |
-4.8 |
0.222 |
2 |
0 |
0 |
0.042 |
Average: |
280.4 |
-5.3 |
0.186 |
2 |
0 |
0 |
0.042 |
11 |
20 |
|
F |
29 |
10 |
14429 |
◊ |
B |
x,y,z |
1_555 |
29 |
7 |
6312 |
289.3 |
-1.1 |
0.732 |
5 |
7 |
0 |
0.000 |
12 |
21 |
|
F |
37 |
11 |
14429 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
28 |
8 |
6324 |
284.2 |
-2.6 |
0.378 |
0 |
0 |
0 |
0.000 |
13 |
22 |
|
B |
27 |
6 |
6312 |
◊ |
G |
x,y,z |
1_555 |
29 |
5 |
6124 |
250.1 |
0.4 |
0.849 |
2 |
2 |
0 |
0.000 |
23 |
|
H |
27 |
6 |
6210 |
◊ |
A |
x,y,z |
1_555 |
25 |
5 |
6324 |
228.4 |
0.1 |
0.791 |
3 |
2 |
0 |
0.000 |
Average: |
239.2 |
0.2 |
0.820 |
3 |
2 |
0 |
0.000 |
14 |
24 |
|
B |
19 |
5 |
6312 |
◊ |
K |
x,y-1,z |
1_545 |
25 |
10 |
15127 |
217.9 |
-1.9 |
0.580 |
5 |
1 |
0 |
0.028 |
25 |
|
E |
24 |
10 |
15344 |
◊ |
H |
x,y-1,z |
1_545 |
20 |
5 |
6210 |
190.6 |
-1.9 |
0.591 |
4 |
1 |
0 |
0.028 |
Average: |
204.2 |
-1.9 |
0.586 |
5 |
1 |
0 |
0.028 |
15 |
26 |
|
K |
22 |
7 |
15127 |
◊ |
J |
x,y,z |
1_555 |
25 |
6 |
6366 |
214.9 |
-0.4 |
0.654 |
4 |
0 |
0 |
0.011 |
27 |
|
E |
25 |
7 |
15344 |
◊ |
D |
x,y,z |
1_555 |
26 |
7 |
6143 |
193.6 |
-1.1 |
0.604 |
3 |
0 |
0 |
0.011 |
Average: |
204.2 |
-0.8 |
0.629 |
4 |
0 |
0 |
0.011 |
16 |
28 |
|
F |
17 |
4 |
14429 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
14 |
6 |
6312 |
183.5 |
-1.1 |
0.495 |
0 |
4 |
0 |
0.000 |
17 |
29 |
|
H |
17 |
5 |
6210 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
6312 |
155.3 |
1.6 |
0.937 |
2 |
7 |
0 |
0.000 |
18 |
30 |
|
E |
16 |
6 |
15344 |
◊ |
K |
x-1,y-1,z |
1_445 |
18 |
6 |
15127 |
150.7 |
-0.1 |
0.636 |
2 |
0 |
0 |
0.000 |
19 |
31 |
|
G |
8 |
5 |
6124 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
6324 |
80.9 |
2.9 |
0.917 |
2 |
3 |
0 |
0.000 |
20 |
32 |
|
K |
8 |
2 |
15127 |
◊ |
H |
x,y,z |
1_555 |
9 |
3 |
6210 |
65.6 |
1.2 |
0.870 |
1 |
2 |
0 |
0.000 |
33 |
|
E |
4 |
2 |
15344 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
6312 |
41.5 |
1.2 |
0.891 |
0 |
0 |
0 |
0.000 |
Average: |
53.6 |
1.2 |
0.881 |
1 |
1 |
0 |
0.000 |
21 |
34 |
|
E |
7 |
3 |
15344 |
◊ |
J |
x,y-1,z |
1_545 |
6 |
2 |
6366 |
55.4 |
0.4 |
0.727 |
1 |
0 |
0 |
0.000 |
22 |
35 |
|
[CA]E:503 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
13 |
6 |
15344 |
49.4 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.092 |
36 |
|
[CA]K:503 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
3 |
3 |
15127 |
32.4 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.092 |
37 |
|
[CA]K:504 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
7 |
6 |
15127 |
31.3 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.092 |
Average: |
37.7 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.092 |
23 |
38 |
|
[CA]E:504 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
10 |
5 |
15344 |
47.8 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.041 |
24 |
39 |
|
[CA]F:503 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
5 |
14429 |
44.2 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.024 |
25 |
40 |
|
[CA]E:501 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
6 |
5 |
15344 |
43.0 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.076 |
41 |
|
[CA]K:502 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
8 |
5 |
15127 |
42.2 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.076 |
Average: |
42.6 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.076 |
26 |
42 |
|
[CA]K:501 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
6 |
5 |
15127 |
43.0 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.044 |
27 |
43 |
|
[CA]F:504 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
10 |
6 |
14429 |
42.5 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.019 |
28 |
44 |
|
[CA]A:101 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
6324 |
41.1 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.170 |
29 |
45 |
|
[CA]F:501 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
4 |
14429 |
39.5 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.027 |
30 |
46 |
|
[CA]C:102 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
7043 |
39.4 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.157 |
31 |
47 |
|
[CA]A:102 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
6324 |
39.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.139 |
32 |
48 |
|
[CA]F:502 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
6 |
5 |
14429 |
37.0 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.025 |
33 |
49 |
|
[CA]C:101 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
5 |
4 |
6143 |
29.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.086 |
34 |
50 |
|
[CA]C:101 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
7043 |
25.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.096 |
35 |
51 |
|
F |
3 |
2 |
14429 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
7043 |
25.2 |
0.5 |
0.790 |
0 |
0 |
0 |
0.000 |
36 |
52 |
|
[CA]G:101 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
3 |
2 |
6124 |
22.8 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.122 |
37 |
53 |
|
[CA]C:103 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
3 |
2 |
7043 |
21.6 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.073 |
38 |
54 |
|
[CA]C:102 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
6143 |
20.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.057 |
39 |
55 |
|
E |
4 |
2 |
15344 |
◊ |
[CA]K:504 |
-x+1,y-1/2,-z-1/2 |
3_644 |
1 |
1 |
85 |
20.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
56 |
|
[CA]E:503 |
1 |
1 |
85 |
◊ |
K |
-x,y-1/2,-z-1/2 |
3_544 |
3 |
1 |
15127 |
17.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
18.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
57 |
|
C |
3 |
1 |
7043 |
◊ |
I |
x,y-1,z |
1_545 |
1 |
1 |
7021 |
19.5 |
0.1 |
0.674 |
0 |
0 |
0 |
0.000 |
41 |
58 |
|
[CA]K:504 |
1 |
1 |
85 |
f |
[CA]K:503 |
x,y,z |
1_555 |
1 |
1 |
85 |
17.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.018 |
42 |
59 |
|
F |
4 |
2 |
14429 |
◊ |
[CA]F:504 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
85 |
14.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
60 |
|
[CA]F:502 |
1 |
1 |
85 |
◊ |
F |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
14429 |
13.8 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
61 |
|
[CA]G:101 |
1 |
1 |
85 |
◊ |
J |
x,y,z |
1_555 |
3 |
1 |
6366 |
13.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.068 |
45 |
62 |
|
[CA]A:102 |
1 |
1 |
85 |
f |
[CA]A:101 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.3 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.078 |
46 |
63 |
|
[CA]E:502 |
1 |
1 |
85 |
◊ |
K |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
2 |
15127 |
10.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
64 |
|
E |
1 |
1 |
15344 |
◊ |
[CA]K:503 |
-x+1,y-1/2,-z-1/2 |
3_644 |
1 |
1 |
85 |
2.4 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
6.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
65 |
|
[CA]E:504 |
1 |
1 |
85 |
f |
[CA]E:501 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.008 |
48 |
66 |
|
[CA]F:502 |
1 |
1 |
85 |
f |
[CA]F:501 |
x,y,z |
1_555 |
1 |
1 |
85 |
6.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.005 |
49 |
67 |
|
[CA]C:103 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
15344 |
4.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
50 |
68 |
|
[CA]F:501 |
1 |
1 |
85 |
◊ |
F |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
14429 |
4.2 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
69 |
|
[CA]E:503 |
1 |
1 |
85 |
f |
[CA]E:502 |
x,y,z |
1_555 |
1 |
1 |
85 |
2.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.003 |
52 |
70 |
|
[CA]A:102 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
6143 |
0.6 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
|