## |
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 |
46 |
11 |
14098 |
◊ |
E |
x,y,z |
1_555 |
47 |
12 |
14406 |
468.7 |
-7.2 |
0.207 |
2 |
0 |
0 |
0.000 |
2 |
|
L |
44 |
13 |
14277 |
◊ |
I |
x,y,z |
1_555 |
48 |
13 |
14027 |
468.6 |
-7.3 |
0.189 |
0 |
0 |
0 |
0.000 |
3 |
|
K |
49 |
12 |
13959 |
◊ |
J |
x,y,z |
1_555 |
45 |
11 |
14395 |
461.2 |
-7.3 |
0.194 |
1 |
0 |
0 |
0.000 |
4 |
|
H |
45 |
12 |
14252 |
◊ |
F |
x,y,z |
1_555 |
44 |
12 |
14427 |
454.4 |
-6.8 |
0.196 |
0 |
0 |
0 |
0.000 |
5 |
|
D |
44 |
10 |
14156 |
◊ |
B |
x,y,z |
1_555 |
43 |
10 |
14258 |
442.0 |
-7.5 |
0.160 |
0 |
0 |
0 |
0.000 |
6 |
|
C |
44 |
10 |
14252 |
◊ |
A |
x,y,z |
1_555 |
44 |
11 |
14249 |
419.2 |
-7.3 |
0.184 |
0 |
0 |
0 |
0.000 |
Average: |
452.4 |
-7.2 |
0.188 |
1 |
0 |
0 |
0.000 |
2 |
7 |
|
L |
47 |
13 |
14277 |
◊ |
J |
x,y,z |
1_555 |
47 |
14 |
14395 |
464.0 |
-11.5 |
0.036 |
2 |
1 |
0 |
0.000 |
8 |
|
B |
44 |
12 |
14258 |
◊ |
A |
x,y,z |
1_555 |
47 |
14 |
14249 |
445.3 |
-10.6 |
0.057 |
1 |
0 |
0 |
0.000 |
9 |
|
D |
43 |
13 |
14156 |
◊ |
C |
x,y,z |
1_555 |
42 |
12 |
14252 |
419.9 |
-10.3 |
0.051 |
1 |
0 |
0 |
0.000 |
10 |
|
H |
40 |
13 |
14252 |
◊ |
G |
x,y,z |
1_555 |
45 |
14 |
14098 |
416.3 |
-10.4 |
0.047 |
1 |
0 |
0 |
0.000 |
11 |
|
F |
40 |
14 |
14427 |
◊ |
E |
x,y,z |
1_555 |
40 |
13 |
14406 |
414.4 |
-11.1 |
0.021 |
0 |
0 |
0 |
0.000 |
12 |
|
K |
40 |
11 |
13959 |
◊ |
I |
x,y,z |
1_555 |
40 |
12 |
14027 |
404.0 |
-11.0 |
0.025 |
1 |
1 |
0 |
0.000 |
Average: |
427.3 |
-10.8 |
0.039 |
1 |
0 |
0 |
0.000 |
3 |
13 |
|
[KZH]H:501 |
21 |
1 |
615 |
f |
H |
x,y,z |
1_555 |
41 |
15 |
14252 |
348.6 |
0.9 |
0.258 |
0 |
0 |
0 |
0.000 |
4 |
14 |
|
[KZH]C:501 |
21 |
1 |
610 |
f |
C |
x,y,z |
1_555 |
41 |
16 |
14252 |
336.1 |
0.4 |
0.227 |
0 |
0 |
0 |
0.000 |
15 |
|
[KZH]E:501 |
20 |
1 |
580 |
f |
E |
x,y,z |
1_555 |
38 |
15 |
14406 |
316.6 |
1.2 |
0.239 |
0 |
0 |
0 |
0.000 |
16 |
|
[KZH]K:501 |
13 |
1 |
424 |
f |
K |
x,y,z |
1_555 |
24 |
9 |
13959 |
208.5 |
4.4 |
0.208 |
1 |
0 |
0 |
0.000 |
17 |
|
[KZH]J:501 |
13 |
1 |
424 |
f |
J |
x,y,z |
1_555 |
24 |
9 |
14395 |
205.7 |
3.7 |
0.135 |
0 |
0 |
0 |
0.000 |
Average: |
266.7 |
2.4 |
0.202 |
0 |
0 |
0 |
0.000 |
5 |
18 |
|
[KZH]B:501 |
21 |
1 |
573 |
f |
B |
x,y,z |
1_555 |
36 |
12 |
14258 |
327.6 |
-0.5 |
0.194 |
0 |
0 |
0 |
0.100 |
6 |
19 |
|
H |
42 |
10 |
14252 |
◊ |
J |
x,y-1,z |
1_545 |
43 |
10 |
14395 |
320.5 |
-3.5 |
0.522 |
5 |
0 |
0 |
0.000 |
20 |
|
E |
38 |
9 |
14406 |
◊ |
C |
x,y,z-1 |
1_554 |
38 |
9 |
14252 |
289.1 |
-3.5 |
0.503 |
2 |
0 |
0 |
0.000 |
21 |
|
B |
37 |
9 |
14258 |
◊ |
I |
x,y-1,z+1 |
1_546 |
34 |
8 |
14027 |
288.6 |
-4.1 |
0.390 |
2 |
0 |
0 |
0.000 |
Average: |
299.4 |
-3.7 |
0.472 |
3 |
0 |
0 |
0.000 |
7 |
22 |
|
F |
33 |
10 |
14427 |
◊ |
I |
x-1,y,z |
1_455 |
38 |
11 |
14027 |
317.7 |
-1.4 |
0.696 |
3 |
4 |
0 |
0.000 |
23 |
|
L |
33 |
10 |
14277 |
◊ |
C |
x,y,z |
1_555 |
32 |
11 |
14252 |
293.9 |
-2.2 |
0.602 |
2 |
3 |
0 |
0.000 |
24 |
|
H |
26 |
10 |
14252 |
◊ |
A |
x-1,y,z |
1_455 |
26 |
7 |
14249 |
251.9 |
-1.9 |
0.578 |
1 |
1 |
0 |
0.000 |
Average: |
287.8 |
-1.8 |
0.625 |
2 |
3 |
0 |
0.000 |
8 |
25 |
|
[KZH]L:501 |
19 |
1 |
546 |
◊ |
L |
x,y,z |
1_555 |
40 |
13 |
14277 |
316.2 |
0.8 |
0.194 |
0 |
0 |
0 |
0.000 |
26 |
|
[KZH]F:501 |
18 |
1 |
536 |
◊ |
F |
x,y,z |
1_555 |
33 |
11 |
14427 |
295.9 |
1.2 |
0.144 |
1 |
0 |
0 |
0.000 |
Average: |
306.1 |
1.0 |
0.169 |
1 |
0 |
0 |
0.000 |
9 |
27 |
|
[KZH]D:501 |
16 |
1 |
488 |
f |
D |
x,y,z |
1_555 |
30 |
10 |
14156 |
259.1 |
2.4 |
0.104 |
0 |
0 |
0 |
0.000 |
10 |
28 |
|
[KZH]G:501 |
16 |
1 |
500 |
◊ |
G |
x,y,z |
1_555 |
26 |
12 |
14098 |
250.2 |
2.6 |
0.215 |
0 |
0 |
0 |
0.000 |
11 |
29 |
|
[KZH]I:501 |
16 |
1 |
477 |
◊ |
I |
x,y,z |
1_555 |
27 |
10 |
14027 |
242.9 |
2.9 |
0.131 |
0 |
0 |
0 |
0.000 |
12 |
30 |
|
J |
23 |
10 |
14395 |
◊ |
I |
x-1,y,z |
1_455 |
23 |
9 |
14027 |
228.1 |
1.6 |
0.880 |
2 |
1 |
0 |
0.000 |
13 |
31 |
|
L |
25 |
7 |
14277 |
◊ |
K |
x,y,z |
1_555 |
23 |
7 |
13959 |
227.5 |
1.1 |
0.859 |
6 |
0 |
0 |
0.000 |
32 |
|
J |
24 |
7 |
14395 |
◊ |
I |
x,y,z |
1_555 |
23 |
7 |
14027 |
224.0 |
1.2 |
0.864 |
6 |
0 |
0 |
0.000 |
33 |
|
H |
21 |
6 |
14252 |
◊ |
E |
x,y,z |
1_555 |
24 |
7 |
14406 |
224.0 |
1.1 |
0.863 |
6 |
0 |
0 |
0.000 |
34 |
|
C |
23 |
6 |
14252 |
◊ |
B |
x,y,z |
1_555 |
24 |
7 |
14258 |
219.5 |
1.3 |
0.873 |
9 |
0 |
0 |
0.000 |
35 |
|
G |
25 |
7 |
14098 |
◊ |
F |
x,y,z |
1_555 |
24 |
7 |
14427 |
217.4 |
1.1 |
0.855 |
6 |
0 |
0 |
0.000 |
36 |
|
D |
23 |
6 |
14156 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
14249 |
213.9 |
1.2 |
0.872 |
6 |
0 |
0 |
0.000 |
Average: |
221.1 |
1.2 |
0.864 |
7 |
0 |
0 |
0.000 |
14 |
37 |
|
[KZH]A:501 |
13 |
1 |
447 |
◊ |
A |
x,y,z |
1_555 |
24 |
9 |
14249 |
216.9 |
3.7 |
0.246 |
0 |
0 |
0 |
0.000 |
15 |
38 |
|
L |
30 |
9 |
14277 |
◊ |
H |
x,y,z |
1_555 |
21 |
8 |
14252 |
207.7 |
-0.9 |
0.672 |
1 |
0 |
0 |
0.000 |
16 |
39 |
|
F |
21 |
6 |
14427 |
◊ |
G |
x-1,y,z |
1_455 |
34 |
11 |
14098 |
206.7 |
1.2 |
0.852 |
3 |
0 |
0 |
0.000 |
40 |
|
A |
30 |
12 |
14249 |
◊ |
D |
x-1,y,z |
1_455 |
21 |
6 |
14156 |
169.4 |
0.3 |
0.782 |
1 |
0 |
0 |
0.000 |
Average: |
188.0 |
0.7 |
0.817 |
2 |
0 |
0 |
0.000 |
17 |
41 |
|
E |
22 |
7 |
14406 |
◊ |
C |
x-1,y,z-1 |
1_454 |
22 |
5 |
14252 |
180.8 |
-0.6 |
0.550 |
1 |
2 |
0 |
0.000 |
18 |
42 |
|
B |
22 |
8 |
14258 |
◊ |
K |
x,y-1,z |
1_545 |
25 |
8 |
13959 |
180.1 |
-0.5 |
0.728 |
1 |
0 |
0 |
0.000 |
19 |
43 |
|
L |
21 |
8 |
14277 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
14249 |
162.7 |
-2.4 |
0.359 |
0 |
0 |
0 |
0.000 |
44 |
|
F |
21 |
8 |
14427 |
◊ |
L |
x-1,y,z |
1_455 |
13 |
4 |
14277 |
160.7 |
-2.5 |
0.238 |
0 |
0 |
0 |
0.000 |
45 |
|
F |
14 |
4 |
14427 |
◊ |
A |
x-1,y,z |
1_455 |
21 |
9 |
14249 |
153.2 |
-2.6 |
0.248 |
0 |
0 |
0 |
0.000 |
Average: |
158.9 |
-2.5 |
0.282 |
0 |
0 |
0 |
0.000 |
20 |
46 |
|
G |
13 |
5 |
14098 |
◊ |
I |
x-1,y,z |
1_455 |
22 |
9 |
14027 |
130.6 |
-0.6 |
0.593 |
1 |
0 |
0 |
0.000 |
47 |
|
K |
8 |
3 |
13959 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
14252 |
101.9 |
-0.6 |
0.514 |
1 |
0 |
0 |
0.000 |
48 |
|
H |
15 |
7 |
14252 |
◊ |
D |
x-1,y,z |
1_455 |
8 |
4 |
14156 |
73.4 |
-0.3 |
0.596 |
1 |
0 |
0 |
0.000 |
Average: |
102.0 |
-0.5 |
0.568 |
1 |
0 |
0 |
0.000 |
21 |
49 |
|
[KZH]B:501 |
15 |
1 |
573 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
14249 |
124.3 |
0.4 |
0.121 |
0 |
0 |
0 |
0.000 |
50 |
|
[KZH]D:501 |
13 |
1 |
488 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
14252 |
103.9 |
1.3 |
0.045 |
0 |
0 |
0 |
0.000 |
51 |
|
[KZH]G:501 |
11 |
1 |
500 |
◊ |
H |
x,y,z |
1_555 |
8 |
3 |
14252 |
91.3 |
1.4 |
0.148 |
0 |
0 |
0 |
0.000 |
Average: |
106.5 |
1.0 |
0.105 |
0 |
0 |
0 |
0.000 |
22 |
52 |
|
E |
14 |
5 |
14406 |
◊ |
L |
x,y,z-1 |
1_554 |
9 |
3 |
14277 |
119.9 |
-1.6 |
0.382 |
0 |
0 |
0 |
0.000 |
23 |
53 |
|
F |
10 |
3 |
14427 |
◊ |
B |
x-1,y+1,z-1 |
1_464 |
13 |
4 |
14258 |
116.9 |
-1.7 |
0.374 |
0 |
0 |
0 |
0.000 |
54 |
|
J |
12 |
4 |
14395 |
◊ |
A |
x-1,y+1,z |
1_465 |
9 |
3 |
14249 |
114.8 |
-1.7 |
0.354 |
0 |
0 |
0 |
0.000 |
Average: |
115.9 |
-1.7 |
0.364 |
0 |
0 |
0 |
0.000 |
24 |
55 |
|
[KZH]L:501 |
13 |
1 |
546 |
f |
J |
x,y,z |
1_555 |
8 |
3 |
14395 |
110.2 |
0.7 |
0.110 |
0 |
0 |
0 |
0.000 |
56 |
|
[KZH]I:501 |
11 |
1 |
477 |
f |
K |
x,y,z |
1_555 |
8 |
3 |
13959 |
98.3 |
1.5 |
0.082 |
0 |
0 |
0 |
0.000 |
Average: |
104.3 |
1.1 |
0.096 |
0 |
0 |
0 |
0.000 |
25 |
57 |
|
[KZH]F:501 |
11 |
1 |
536 |
f |
E |
x,y,z |
1_555 |
8 |
3 |
14406 |
104.4 |
0.9 |
0.122 |
0 |
0 |
0 |
0.000 |
26 |
58 |
|
G |
12 |
4 |
14098 |
◊ |
K |
x,y,z-1 |
1_554 |
10 |
4 |
13959 |
98.9 |
-1.8 |
0.354 |
1 |
0 |
0 |
0.000 |
27 |
59 |
|
[KZH]K:501 |
10 |
1 |
424 |
◊ |
I |
x,y,z |
1_555 |
8 |
3 |
14027 |
95.0 |
1.6 |
0.073 |
0 |
0 |
0 |
0.000 |
60 |
|
[KZH]J:501 |
12 |
1 |
424 |
◊ |
L |
x,y,z |
1_555 |
8 |
3 |
14277 |
89.3 |
1.5 |
0.041 |
0 |
0 |
0 |
0.000 |
61 |
|
[KZH]E:501 |
10 |
1 |
580 |
◊ |
F |
x,y,z |
1_555 |
7 |
2 |
14427 |
87.2 |
1.6 |
0.225 |
0 |
0 |
0 |
0.000 |
62 |
|
[KZH]C:501 |
11 |
1 |
610 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
14156 |
79.1 |
1.7 |
0.300 |
0 |
0 |
0 |
0.000 |
Average: |
87.6 |
1.6 |
0.160 |
0 |
0 |
0 |
0.000 |
28 |
63 |
|
[KZH]G:501 |
8 |
1 |
500 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
14427 |
94.7 |
2.8 |
0.450 |
3 |
0 |
0 |
0.000 |
29 |
64 |
|
[KZH]E:501 |
7 |
1 |
580 |
◊ |
H |
x,y,z |
1_555 |
12 |
5 |
14252 |
94.4 |
3.0 |
0.672 |
3 |
0 |
0 |
0.000 |
65 |
|
[KZH]C:501 |
8 |
1 |
610 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
14258 |
93.6 |
2.7 |
0.614 |
2 |
0 |
0 |
0.000 |
66 |
|
[KZH]K:501 |
6 |
1 |
424 |
◊ |
L |
x,y,z |
1_555 |
10 |
5 |
14277 |
80.3 |
2.2 |
0.248 |
3 |
0 |
0 |
0.000 |
Average: |
89.5 |
2.6 |
0.511 |
3 |
0 |
0 |
0.000 |
30 |
67 |
|
[KZH]A:501 |
6 |
1 |
447 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
14156 |
94.0 |
2.8 |
0.419 |
3 |
0 |
0 |
0.000 |
31 |
68 |
|
[KZH]F:501 |
8 |
1 |
536 |
◊ |
G |
x,y,z |
1_555 |
12 |
5 |
14098 |
93.9 |
2.8 |
0.489 |
2 |
0 |
0 |
0.000 |
32 |
69 |
|
[KZH]I:501 |
9 |
1 |
477 |
◊ |
J |
x,y,z |
1_555 |
11 |
5 |
14395 |
91.6 |
2.9 |
0.267 |
3 |
0 |
0 |
0.000 |
70 |
|
[KZH]L:501 |
5 |
1 |
546 |
◊ |
K |
x,y,z |
1_555 |
12 |
5 |
13959 |
84.8 |
2.6 |
0.708 |
3 |
0 |
0 |
0.000 |
Average: |
88.2 |
2.7 |
0.487 |
3 |
0 |
0 |
0.000 |
33 |
71 |
|
[KZH]D:501 |
6 |
1 |
488 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
14249 |
90.4 |
2.6 |
0.425 |
3 |
0 |
0 |
0.000 |
72 |
|
[KZH]B:501 |
7 |
1 |
573 |
◊ |
C |
x,y,z |
1_555 |
14 |
6 |
14252 |
90.4 |
2.8 |
0.730 |
3 |
0 |
0 |
0.000 |
Average: |
90.4 |
2.7 |
0.578 |
3 |
0 |
0 |
0.000 |
34 |
73 |
|
G |
9 |
4 |
14098 |
◊ |
D |
x-1,y+1,z-1 |
1_464 |
10 |
3 |
14156 |
89.7 |
-1.8 |
0.304 |
0 |
0 |
0 |
0.000 |
74 |
|
K |
9 |
3 |
13959 |
◊ |
D |
x-1,y+1,z |
1_465 |
9 |
3 |
14156 |
81.8 |
-1.4 |
0.374 |
0 |
0 |
0 |
0.000 |
Average: |
85.7 |
-1.6 |
0.339 |
0 |
0 |
0 |
0.000 |
35 |
75 |
|
[KZH]H:501 |
7 |
1 |
615 |
◊ |
E |
x,y,z |
1_555 |
11 |
4 |
14406 |
87.4 |
2.4 |
0.618 |
3 |
0 |
0 |
0.000 |
36 |
76 |
|
[KZH]A:501 |
9 |
1 |
447 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
14258 |
84.9 |
1.6 |
0.141 |
0 |
0 |
0 |
0.000 |
37 |
77 |
|
[KZH]J:501 |
7 |
1 |
424 |
◊ |
I |
x,y,z |
1_555 |
11 |
5 |
14027 |
82.4 |
2.3 |
0.214 |
3 |
0 |
0 |
0.000 |
38 |
78 |
|
[KZH]H:501 |
9 |
1 |
615 |
◊ |
G |
x,y,z |
1_555 |
8 |
3 |
14098 |
82.4 |
1.5 |
0.315 |
0 |
0 |
0 |
0.000 |
39 |
79 |
|
J |
8 |
5 |
14395 |
◊ |
D |
x-1,y+1,z |
1_465 |
12 |
4 |
14156 |
76.9 |
0.3 |
0.758 |
0 |
0 |
0 |
0.000 |
80 |
|
G |
3 |
3 |
14098 |
◊ |
B |
x-1,y+1,z-1 |
1_464 |
3 |
3 |
14258 |
16.7 |
0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
Average: |
46.8 |
0.1 |
0.672 |
0 |
0 |
0 |
0.000 |
40 |
81 |
|
A |
8 |
3 |
14249 |
◊ |
K |
x,y-1,z |
1_545 |
10 |
4 |
13959 |
70.0 |
-1.3 |
0.394 |
0 |
0 |
0 |
0.000 |
41 |
82 |
|
L |
9 |
4 |
14277 |
◊ |
G |
x,y,z |
1_555 |
6 |
2 |
14098 |
59.6 |
-0.7 |
0.435 |
0 |
0 |
0 |
0.000 |
42 |
83 |
|
E |
1 |
1 |
14406 |
◊ |
D |
x-1,y,z-1 |
1_454 |
8 |
4 |
14156 |
25.7 |
0.3 |
0.817 |
0 |
0 |
0 |
0.000 |
43 |
84 |
|
E |
1 |
1 |
14406 |
◊ |
K |
x,y,z-1 |
1_554 |
1 |
1 |
13959 |
1.9 |
0.0 |
0.608 |
0 |
0 |
0 |
0.000 |
|