## |
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 |
|
G |
164 |
38 |
7030 |
◊ |
F |
x,y,z |
1_555 |
198 |
54 |
10059 |
1834.9 |
-28.8 |
0.096 |
18 |
13 |
0 |
1.000 |
2 |
|
J |
150 |
33 |
6809 |
◊ |
A |
x,y,z |
1_555 |
184 |
52 |
10355 |
1750.7 |
-24.3 |
0.088 |
15 |
9 |
0 |
1.000 |
3 |
|
L |
148 |
34 |
6969 |
◊ |
K |
x,y,z |
1_555 |
169 |
49 |
10065 |
1642.2 |
-23.0 |
0.113 |
16 |
10 |
0 |
1.000 |
4 |
|
I |
135 |
33 |
7066 |
◊ |
H |
x,y,z |
1_555 |
171 |
46 |
10164 |
1498.9 |
-21.9 |
0.136 |
12 |
10 |
0 |
1.000 |
5 |
|
C |
128 |
32 |
6787 |
◊ |
B |
x,y,z |
1_555 |
151 |
44 |
10511 |
1425.0 |
-19.3 |
0.129 |
13 |
12 |
0 |
1.000 |
6 |
|
E |
127 |
29 |
6868 |
◊ |
D |
x,y,z |
1_555 |
143 |
41 |
9729 |
1363.1 |
-18.5 |
0.132 |
15 |
11 |
0 |
1.000 |
7 |
|
P |
107 |
25 |
6154 |
◊ |
O |
x,y,z |
1_555 |
130 |
37 |
9554 |
1179.3 |
-14.7 |
0.258 |
12 |
9 |
0 |
1.000 |
Average: |
1527.7 |
-21.5 |
0.136 |
14 |
11 |
0 |
1.000 |
2 |
8 |
|
N |
115 |
27 |
6076 |
◊ |
M |
x,y,z |
1_555 |
133 |
40 |
9876 |
1248.4 |
-15.7 |
0.173 |
11 |
9 |
0 |
0.803 |
3 |
9 |
|
J |
67 |
14 |
6809 |
◊ |
C |
x,y,z |
1_555 |
72 |
20 |
6787 |
672.1 |
-11.0 |
0.281 |
2 |
1 |
0 |
1.000 |
10 |
|
L |
64 |
14 |
6969 |
◊ |
E |
x,y,z |
1_555 |
72 |
20 |
6868 |
645.7 |
-10.3 |
0.310 |
4 |
0 |
0 |
1.000 |
11 |
|
I |
73 |
19 |
7066 |
◊ |
G |
x,y,z |
1_555 |
64 |
15 |
7030 |
643.7 |
-12.0 |
0.267 |
1 |
0 |
0 |
1.000 |
12 |
|
P |
56 |
20 |
6154 |
◊ |
N |
x,y,z |
1_555 |
49 |
11 |
6076 |
493.7 |
-9.3 |
0.281 |
1 |
0 |
0 |
1.000 |
Average: |
613.8 |
-10.6 |
0.285 |
2 |
0 |
0 |
1.000 |
4 |
13 |
|
F |
54 |
17 |
10059 |
◊ |
A |
x,y,z |
1_555 |
53 |
16 |
10355 |
503.5 |
0.7 |
0.781 |
3 |
1 |
0 |
0.000 |
5 |
14 |
|
N |
42 |
13 |
6076 |
◊ |
N |
x,-y,-z+1 |
4_556 |
42 |
13 |
6076 |
484.3 |
-9.7 |
0.169 |
2 |
2 |
0 |
1.000 |
6 |
15 |
|
J |
40 |
12 |
6809 |
◊ |
J |
-x-1,y,-z+1/2 |
3_455 |
39 |
12 |
6809 |
442.9 |
-6.7 |
0.314 |
2 |
2 |
0 |
0.100 |
16 |
|
L |
40 |
13 |
6969 |
◊ |
G |
x,y,z |
1_555 |
43 |
14 |
7030 |
431.0 |
-9.1 |
0.190 |
1 |
1 |
0 |
0.100 |
Average: |
437.0 |
-7.9 |
0.252 |
2 |
2 |
0 |
0.100 |
7 |
17 |
|
D |
48 |
14 |
9729 |
◊ |
A |
x,y,z |
1_555 |
52 |
13 |
10355 |
428.5 |
-1.0 |
0.617 |
5 |
1 |
0 |
0.000 |
18 |
|
F |
53 |
12 |
10059 |
◊ |
B |
-x-1,y,-z+1/2 |
3_455 |
47 |
14 |
10511 |
402.4 |
-0.4 |
0.701 |
4 |
0 |
0 |
0.000 |
Average: |
415.5 |
-0.7 |
0.659 |
5 |
1 |
0 |
0.000 |
8 |
19 |
|
K |
51 |
12 |
10065 |
◊ |
H |
-x-1,y,-z-1/2 |
3_454 |
42 |
15 |
10164 |
424.3 |
-0.4 |
0.697 |
4 |
0 |
0 |
0.000 |
9 |
20 |
|
A |
45 |
12 |
10355 |
◊ |
A |
x,-y,-z |
4_555 |
45 |
12 |
10355 |
379.2 |
-5.4 |
0.242 |
0 |
0 |
0 |
0.000 |
10 |
21 |
|
M |
37 |
12 |
9876 |
◊ |
B |
-x-1,y,-z+1/2 |
3_455 |
39 |
11 |
10511 |
344.2 |
-2.4 |
0.480 |
2 |
0 |
0 |
0.000 |
11 |
22 |
|
K |
37 |
10 |
10065 |
◊ |
F |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
35 |
10 |
10059 |
331.6 |
-3.5 |
0.376 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
K |
28 |
9 |
10065 |
◊ |
K |
-x-1,y,-z-1/2 |
3_454 |
30 |
9 |
10065 |
262.9 |
3.5 |
0.915 |
2 |
0 |
0 |
0.000 |
13 |
24 |
|
M |
28 |
8 |
9876 |
◊ |
M |
-x,y,-z+1/2 |
3_555 |
28 |
8 |
9876 |
242.9 |
-3.1 |
0.350 |
0 |
0 |
0 |
0.000 |
14 |
25 |
|
I |
23 |
8 |
7066 |
◊ |
F |
x,y,z |
1_555 |
25 |
8 |
10059 |
234.1 |
-4.4 |
0.249 |
2 |
0 |
0 |
0.077 |
26 |
|
P |
23 |
8 |
6154 |
◊ |
M |
x,y,z |
1_555 |
24 |
8 |
9876 |
224.9 |
-4.0 |
0.277 |
2 |
0 |
0 |
0.077 |
27 |
|
E |
24 |
9 |
6868 |
◊ |
K |
x,y,z |
1_555 |
24 |
8 |
10065 |
222.6 |
-4.0 |
0.227 |
1 |
0 |
0 |
0.077 |
28 |
|
C |
23 |
9 |
6787 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
10355 |
208.4 |
-4.9 |
0.178 |
3 |
0 |
0 |
0.077 |
Average: |
222.5 |
-4.3 |
0.233 |
2 |
0 |
0 |
0.077 |
15 |
29 |
|
P |
25 |
5 |
6154 |
◊ |
N |
x,-y,-z+1 |
4_556 |
26 |
7 |
6076 |
226.9 |
-1.2 |
0.656 |
1 |
2 |
0 |
0.115 |
16 |
30 |
|
G |
23 |
6 |
7030 |
◊ |
E |
x,y,z |
1_555 |
22 |
6 |
6868 |
199.7 |
-0.1 |
0.756 |
1 |
4 |
0 |
0.011 |
31 |
|
L |
20 |
6 |
6969 |
◊ |
I |
x,y,z |
1_555 |
22 |
6 |
7066 |
168.7 |
-0.3 |
0.694 |
0 |
0 |
0 |
0.011 |
32 |
|
J |
19 |
5 |
6809 |
◊ |
C |
-x-1,y,-z+1/2 |
3_455 |
17 |
5 |
6787 |
160.2 |
-0.5 |
0.639 |
2 |
4 |
0 |
0.011 |
Average: |
176.2 |
-0.3 |
0.696 |
1 |
3 |
0 |
0.011 |
17 |
33 |
|
N |
24 |
10 |
6076 |
◊ |
B |
-x-1,y,-z+1/2 |
3_455 |
19 |
5 |
10511 |
189.5 |
1.3 |
0.799 |
2 |
4 |
0 |
0.000 |
18 |
34 |
|
G |
24 |
8 |
7030 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
10355 |
188.0 |
-3.0 |
0.275 |
2 |
0 |
0 |
0.000 |
35 |
|
J |
21 |
6 |
6809 |
◊ |
F |
x,y,z |
1_555 |
19 |
7 |
10059 |
181.1 |
-3.2 |
0.288 |
1 |
0 |
0 |
0.000 |
Average: |
184.5 |
-3.1 |
0.281 |
2 |
0 |
0 |
0.000 |
19 |
36 |
|
H |
14 |
4 |
10164 |
◊ |
O |
-x-1/2,y-1/2,-z+1/2 |
7_445 |
11 |
2 |
9554 |
121.1 |
-1.4 |
0.380 |
1 |
0 |
0 |
0.000 |
20 |
37 |
|
N |
7 |
3 |
6076 |
◊ |
M |
-x,y,-z+1/2 |
3_555 |
11 |
3 |
9876 |
95.3 |
-0.1 |
0.612 |
1 |
1 |
0 |
0.000 |
21 |
38 |
|
K |
10 |
3 |
10065 |
◊ |
G |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
9 |
3 |
7030 |
92.1 |
-0.9 |
0.494 |
0 |
0 |
0 |
0.000 |
22 |
39 |
|
O |
13 |
6 |
9554 |
◊ |
D |
x,-y,-z |
4_555 |
15 |
4 |
9729 |
89.3 |
0.9 |
0.727 |
2 |
3 |
0 |
0.000 |
23 |
40 |
|
P |
19 |
5 |
6154 |
◊ |
M |
-x,y,-z+1/2 |
3_555 |
9 |
4 |
9876 |
86.4 |
-0.8 |
0.534 |
0 |
0 |
0 |
0.000 |
24 |
41 |
|
J |
7 |
4 |
6809 |
◊ |
A |
x,-y,-z |
4_555 |
8 |
3 |
10355 |
80.0 |
-0.3 |
0.581 |
0 |
0 |
0 |
0.000 |
42 |
|
L |
5 |
2 |
6969 |
◊ |
F |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
7 |
3 |
10059 |
38.2 |
-0.5 |
0.507 |
0 |
0 |
0 |
0.000 |
Average: |
59.1 |
-0.4 |
0.544 |
0 |
0 |
0 |
0.000 |
25 |
43 |
|
[CL]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
10511 |
72.3 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.231 |
44 |
|
[CL]K:301 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
9 |
6 |
10065 |
69.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.231 |
45 |
|
[CL]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
10355 |
62.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.231 |
46 |
|
[CL]F:301 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
7 |
5 |
10059 |
61.9 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.231 |
47 |
|
[CL]D:301 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
9729 |
61.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.231 |
48 |
|
[CL]H:301 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
8 |
5 |
10164 |
61.0 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.231 |
49 |
|
[CL]M:301 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
8 |
5 |
9876 |
56.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.231 |
Average: |
63.6 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.231 |
26 |
50 |
|
C |
10 |
6 |
6787 |
◊ |
F |
-x-1,y,-z+1/2 |
3_455 |
9 |
5 |
10059 |
67.8 |
0.1 |
0.637 |
0 |
0 |
0 |
0.000 |
51 |
|
E |
9 |
5 |
6868 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
10355 |
67.7 |
0.1 |
0.554 |
0 |
0 |
0 |
0.000 |
Average: |
67.7 |
0.1 |
0.596 |
0 |
0 |
0 |
0.000 |
27 |
52 |
|
I |
4 |
2 |
7066 |
◊ |
K |
-x-1,y,-z-1/2 |
3_454 |
6 |
3 |
10065 |
52.4 |
1.1 |
0.834 |
0 |
0 |
0 |
0.000 |
28 |
53 |
|
K |
8 |
3 |
10065 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
9729 |
52.3 |
-0.8 |
0.441 |
0 |
0 |
0 |
0.009 |
54 |
|
B |
6 |
2 |
10511 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
10355 |
42.0 |
-0.7 |
0.404 |
0 |
0 |
0 |
0.009 |
55 |
|
O |
11 |
3 |
9554 |
◊ |
M |
x,y,z |
1_555 |
8 |
4 |
9876 |
33.5 |
-0.4 |
0.560 |
0 |
0 |
0 |
0.009 |
56 |
|
H |
8 |
3 |
10164 |
◊ |
F |
x,y,z |
1_555 |
4 |
3 |
10059 |
25.7 |
-0.5 |
0.460 |
0 |
0 |
0 |
0.009 |
Average: |
38.4 |
-0.6 |
0.466 |
0 |
0 |
0 |
0.009 |
29 |
57 |
|
G |
8 |
5 |
7030 |
◊ |
H |
x,y,z |
1_555 |
4 |
1 |
10164 |
51.8 |
0.2 |
0.324 |
0 |
0 |
0 |
0.005 |
58 |
|
L |
6 |
4 |
6969 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
9729 |
35.8 |
-0.4 |
0.346 |
0 |
0 |
0 |
0.005 |
59 |
|
J |
6 |
2 |
6809 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
10511 |
23.4 |
-0.5 |
0.417 |
0 |
0 |
0 |
0.005 |
60 |
|
N |
3 |
2 |
6076 |
◊ |
O |
x,y,z |
1_555 |
2 |
1 |
9554 |
18.6 |
-0.1 |
0.446 |
0 |
0 |
0 |
0.005 |
Average: |
32.4 |
-0.2 |
0.383 |
0 |
0 |
0 |
0.005 |
30 |
61 |
|
P |
4 |
2 |
6154 |
◊ |
P |
x,-y,-z+1 |
4_556 |
4 |
2 |
6154 |
46.5 |
0.4 |
0.759 |
0 |
0 |
0 |
0.000 |
31 |
62 |
|
L |
6 |
3 |
6969 |
◊ |
K |
-x-1,y,-z-1/2 |
3_454 |
5 |
1 |
10065 |
44.0 |
-0.4 |
0.530 |
0 |
0 |
0 |
0.000 |
32 |
63 |
|
B |
4 |
2 |
10511 |
◊ |
O |
-x-1,-y,z-1/2 |
2_454 |
8 |
4 |
9554 |
36.2 |
-0.4 |
0.506 |
0 |
0 |
0 |
0.000 |
33 |
64 |
|
J |
4 |
1 |
6809 |
◊ |
B |
-x-1,y,-z+1/2 |
3_455 |
3 |
1 |
10511 |
34.5 |
0.1 |
0.616 |
0 |
0 |
0 |
0.000 |
34 |
65 |
|
B |
1 |
1 |
10511 |
◊ |
A |
-x-1,y,-z+1/2 |
3_455 |
2 |
1 |
10355 |
20.1 |
-0.1 |
0.325 |
0 |
0 |
0 |
0.000 |
66 |
|
F |
1 |
1 |
10059 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
9729 |
3.5 |
-0.0 |
0.551 |
0 |
0 |
0 |
0.000 |
Average: |
11.8 |
-0.0 |
0.438 |
0 |
0 |
0 |
0.000 |
35 |
67 |
|
K |
3 |
2 |
10065 |
◊ |
I |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
3 |
2 |
7066 |
18.8 |
-0.1 |
0.575 |
0 |
0 |
0 |
0.000 |
36 |
68 |
|
L |
2 |
1 |
6969 |
◊ |
I |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
1 |
1 |
7066 |
16.8 |
0.2 |
0.739 |
0 |
0 |
0 |
0.000 |
37 |
69 |
|
[CL]F:301 |
1 |
1 |
125 |
◊ |
C |
-x-1,y,-z+1/2 |
3_455 |
1 |
1 |
6787 |
11.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
70 |
|
[CL]K:301 |
1 |
1 |
125 |
◊ |
I |
-x-1,y,-z-1/2 |
3_454 |
1 |
1 |
7066 |
0.3 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
5.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
71 |
|
E |
1 |
1 |
6868 |
◊ |
G |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
1 |
1 |
7030 |
6.5 |
-0.1 |
0.539 |
0 |
0 |
0 |
0.000 |
39 |
72 |
|
C |
2 |
1 |
6787 |
◊ |
A |
x,-y,-z |
4_555 |
1 |
1 |
10355 |
3.6 |
0.0 |
0.690 |
0 |
0 |
0 |
0.000 |
40 |
73 |
|
E |
1 |
1 |
6868 |
◊ |
F |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
1 |
1 |
10059 |
1.3 |
0.0 |
0.655 |
0 |
0 |
0 |
0.000 |
41 |
74 |
|
L |
1 |
1 |
6969 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
10059 |
0.5 |
0.0 |
0.668 |
0 |
0 |
0 |
0.000 |
|