## |
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 |
|
F |
145 |
32 |
10930 |
◊ |
E |
x,y,z |
1_555 |
142 |
33 |
10458 |
1395.7 |
-25.3 |
0.005 |
14 |
4 |
0 |
0.599 |
2 |
|
B |
144 |
33 |
10489 |
◊ |
A |
x,y,z |
1_555 |
141 |
32 |
10740 |
1395.2 |
-23.2 |
0.010 |
13 |
7 |
0 |
0.599 |
3 |
|
L |
145 |
32 |
10700 |
◊ |
K |
x,y,z |
1_555 |
137 |
29 |
10330 |
1366.0 |
-22.9 |
0.021 |
12 |
1 |
0 |
0.599 |
4 |
|
J |
125 |
32 |
10828 |
◊ |
I |
x,y,z |
1_555 |
128 |
28 |
10425 |
1261.8 |
-21.0 |
0.024 |
12 |
2 |
0 |
0.599 |
5 |
|
D |
134 |
32 |
10709 |
◊ |
C |
x,y,z |
1_555 |
128 |
28 |
10282 |
1244.4 |
-22.3 |
0.016 |
12 |
4 |
0 |
0.599 |
6 |
|
H |
122 |
25 |
9200 |
◊ |
G |
x,y,z |
1_555 |
130 |
31 |
10803 |
1237.7 |
-23.1 |
0.020 |
12 |
4 |
0 |
0.599 |
Average: |
1316.8 |
-23.0 |
0.016 |
13 |
4 |
0 |
0.599 |
2 |
7 |
|
C |
99 |
32 |
10282 |
◊ |
B |
x,y,z |
1_555 |
97 |
29 |
10489 |
1024.5 |
1.4 |
0.837 |
16 |
13 |
0 |
0.177 |
8 |
|
E |
99 |
32 |
10458 |
◊ |
A |
x,y,z |
1_555 |
99 |
29 |
10740 |
1023.4 |
-2.1 |
0.669 |
15 |
12 |
0 |
0.177 |
9 |
|
K |
94 |
29 |
10330 |
◊ |
G |
x,y,z |
1_555 |
96 |
30 |
10803 |
985.9 |
-3.6 |
0.615 |
15 |
13 |
0 |
0.177 |
10 |
|
L |
95 |
29 |
10700 |
◊ |
J |
x,y,z |
1_555 |
93 |
29 |
10828 |
985.0 |
-3.4 |
0.560 |
16 |
14 |
0 |
0.177 |
11 |
|
F |
96 |
30 |
10930 |
◊ |
D |
x,y,z |
1_555 |
98 |
29 |
10709 |
980.1 |
-1.3 |
0.697 |
15 |
12 |
0 |
0.177 |
12 |
|
I |
93 |
30 |
10425 |
◊ |
H |
x,y,z |
1_555 |
93 |
29 |
9200 |
968.5 |
-3.1 |
0.738 |
16 |
12 |
0 |
0.177 |
Average: |
994.6 |
-2.0 |
0.686 |
16 |
13 |
0 |
0.177 |
3 |
13 |
|
L |
55 |
16 |
10700 |
◊ |
F |
x,y,z |
1_555 |
57 |
19 |
10930 |
527.6 |
4.4 |
0.911 |
8 |
8 |
0 |
0.000 |
14 |
|
D |
57 |
19 |
10709 |
◊ |
J |
x-1/2,y-1/2,z |
3_445 |
58 |
17 |
10828 |
519.4 |
3.5 |
0.890 |
7 |
9 |
0 |
0.000 |
15 |
|
G |
54 |
19 |
10803 |
◊ |
G |
-x,y,-z |
2_555 |
54 |
19 |
10803 |
474.5 |
0.8 |
0.775 |
12 |
2 |
0 |
0.000 |
Average: |
507.2 |
2.9 |
0.859 |
9 |
6 |
0 |
0.000 |
4 |
16 |
|
A |
48 |
14 |
10740 |
◊ |
B |
-x-1/2,y-1/2,-z-1 |
4_444 |
46 |
13 |
10489 |
417.1 |
4.9 |
0.926 |
8 |
7 |
0 |
0.000 |
5 |
17 |
|
[UTP]E:1227 |
29 |
1 |
585 |
f |
E |
x,y,z |
1_555 |
67 |
30 |
10458 |
410.3 |
-4.1 |
0.555 |
19 |
0 |
0 |
0.192 |
18 |
|
[UTP]A:1227 |
29 |
1 |
571 |
f |
A |
x,y,z |
1_555 |
48 |
25 |
10740 |
363.0 |
-1.3 |
0.662 |
12 |
0 |
0 |
0.192 |
19 |
|
[UTP]H:1227 |
28 |
1 |
586 |
f |
H |
x,y,z |
1_555 |
55 |
26 |
9200 |
361.2 |
-3.6 |
0.616 |
13 |
0 |
0 |
0.192 |
20 |
|
[UTP]D:1227 |
27 |
1 |
575 |
f |
D |
x,y,z |
1_555 |
47 |
23 |
10709 |
348.1 |
-1.2 |
0.707 |
11 |
0 |
0 |
0.192 |
21 |
|
[UTP]J:1227 |
29 |
1 |
569 |
f |
J |
x,y,z |
1_555 |
49 |
24 |
10828 |
325.9 |
-1.7 |
0.631 |
10 |
0 |
0 |
0.192 |
Average: |
361.7 |
-2.4 |
0.634 |
13 |
0 |
0 |
0.192 |
6 |
22 |
|
[UTP]F:1227 |
29 |
1 |
584 |
f |
F |
x,y,z |
1_555 |
61 |
29 |
10930 |
410.1 |
-4.6 |
0.537 |
14 |
0 |
0 |
0.204 |
23 |
|
[UTP]C:1227 |
29 |
1 |
588 |
f |
C |
x,y,z |
1_555 |
65 |
30 |
10282 |
391.3 |
-2.7 |
0.626 |
18 |
0 |
0 |
0.204 |
24 |
|
[UTP]I:1227 |
27 |
1 |
586 |
f |
I |
x,y,z |
1_555 |
55 |
25 |
10425 |
366.8 |
-3.6 |
0.604 |
13 |
0 |
0 |
0.204 |
25 |
|
[UTP]B:1227 |
27 |
1 |
587 |
f |
B |
x,y,z |
1_555 |
46 |
22 |
10489 |
349.9 |
-2.8 |
0.617 |
15 |
0 |
0 |
0.204 |
26 |
|
[UTP]L:1227 |
28 |
1 |
582 |
f |
L |
x,y,z |
1_555 |
48 |
24 |
10700 |
339.1 |
-3.9 |
0.531 |
15 |
0 |
0 |
0.204 |
Average: |
371.4 |
-3.5 |
0.583 |
15 |
0 |
0 |
0.204 |
7 |
27 |
|
[UTP]G:1227 |
29 |
1 |
583 |
f |
G |
x,y,z |
1_555 |
58 |
28 |
10803 |
381.2 |
-3.9 |
0.527 |
14 |
0 |
0 |
0.209 |
8 |
28 |
|
[UTP]K:1227 |
29 |
1 |
572 |
f |
K |
x,y,z |
1_555 |
51 |
24 |
10330 |
329.4 |
-2.2 |
0.631 |
7 |
0 |
0 |
0.102 |
9 |
29 |
|
I |
26 |
9 |
10425 |
◊ |
G |
x,y,z |
1_555 |
34 |
11 |
10803 |
268.4 |
0.5 |
0.744 |
5 |
0 |
0 |
0.064 |
30 |
|
K |
34 |
11 |
10330 |
◊ |
J |
x,y,z |
1_555 |
27 |
9 |
10828 |
268.2 |
0.1 |
0.713 |
6 |
0 |
0 |
0.064 |
31 |
|
D |
36 |
11 |
10709 |
◊ |
B |
x,y,z |
1_555 |
27 |
11 |
10489 |
268.1 |
-0.6 |
0.602 |
4 |
0 |
0 |
0.064 |
32 |
|
L |
26 |
9 |
10700 |
◊ |
I |
x,y,z |
1_555 |
33 |
11 |
10425 |
261.2 |
-0.1 |
0.694 |
5 |
0 |
0 |
0.064 |
33 |
|
K |
25 |
8 |
10330 |
◊ |
H |
x,y,z |
1_555 |
33 |
11 |
9200 |
260.1 |
-0.0 |
0.744 |
5 |
0 |
0 |
0.064 |
34 |
|
E |
26 |
10 |
10458 |
◊ |
B |
x,y,z |
1_555 |
36 |
11 |
10489 |
260.0 |
-0.8 |
0.583 |
3 |
0 |
0 |
0.064 |
35 |
|
J |
30 |
10 |
10828 |
◊ |
H |
x,y,z |
1_555 |
23 |
8 |
9200 |
258.8 |
-0.0 |
0.704 |
4 |
0 |
0 |
0.064 |
36 |
|
L |
32 |
11 |
10700 |
◊ |
G |
x,y,z |
1_555 |
25 |
9 |
10803 |
257.7 |
0.3 |
0.699 |
5 |
0 |
0 |
0.064 |
37 |
|
C |
22 |
9 |
10282 |
◊ |
A |
x,y,z |
1_555 |
35 |
11 |
10740 |
251.2 |
-0.9 |
0.605 |
3 |
0 |
0 |
0.064 |
38 |
|
E |
34 |
10 |
10458 |
◊ |
D |
x,y,z |
1_555 |
23 |
9 |
10709 |
248.3 |
-0.3 |
0.646 |
4 |
0 |
0 |
0.064 |
39 |
|
F |
34 |
10 |
10930 |
◊ |
A |
x,y,z |
1_555 |
23 |
8 |
10740 |
239.9 |
-1.0 |
0.555 |
4 |
0 |
0 |
0.064 |
40 |
|
F |
25 |
9 |
10930 |
◊ |
C |
x,y,z |
1_555 |
37 |
12 |
10282 |
236.9 |
-1.7 |
0.513 |
3 |
0 |
0 |
0.064 |
Average: |
256.6 |
-0.4 |
0.650 |
4 |
0 |
0 |
0.064 |
10 |
41 |
|
B |
28 |
7 |
10489 |
◊ |
E |
-x-1/2,y-1/2,-z-1 |
4_444 |
34 |
12 |
10458 |
264.0 |
-2.0 |
0.423 |
1 |
0 |
0 |
0.000 |
11 |
42 |
|
D |
29 |
6 |
10709 |
◊ |
I |
x-1/2,y-1/2,z |
3_445 |
34 |
7 |
10425 |
255.1 |
-1.0 |
0.606 |
4 |
4 |
0 |
0.000 |
43 |
|
K |
32 |
7 |
10330 |
◊ |
F |
x,y,z |
1_555 |
30 |
7 |
10930 |
243.4 |
-1.3 |
0.559 |
1 |
4 |
0 |
0.000 |
44 |
|
L |
26 |
6 |
10700 |
◊ |
E |
x,y,z |
1_555 |
30 |
9 |
10458 |
242.7 |
-1.8 |
0.403 |
1 |
0 |
0 |
0.000 |
45 |
|
H |
26 |
5 |
9200 |
◊ |
G |
-x,y,-z |
2_555 |
26 |
8 |
10803 |
236.8 |
-1.1 |
0.550 |
2 |
2 |
0 |
0.000 |
46 |
|
C |
25 |
5 |
10282 |
◊ |
J |
x-1/2,y-1/2,z |
3_445 |
27 |
6 |
10828 |
221.5 |
-1.9 |
0.436 |
1 |
0 |
0 |
0.000 |
Average: |
239.9 |
-1.5 |
0.511 |
2 |
2 |
0 |
0.000 |
12 |
47 |
|
C |
16 |
5 |
10282 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
16 |
4 |
10740 |
124.1 |
-1.2 |
0.467 |
1 |
0 |
0 |
0.000 |
13 |
48 |
|
A |
7 |
4 |
10740 |
x |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
12 |
4 |
10740 |
88.6 |
-1.2 |
0.261 |
0 |
0 |
0 |
0.000 |
14 |
49 |
|
[MG]J:1228 |
1 |
1 |
98 |
f |
[UTP]J:1227 |
x,y,z |
1_555 |
8 |
1 |
569 |
45.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.209 |
50 |
|
[MG]D:1228 |
1 |
1 |
98 |
f |
[UTP]D:1227 |
x,y,z |
1_555 |
9 |
1 |
575 |
44.1 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.209 |
51 |
|
[MG]L:1228 |
1 |
1 |
98 |
f |
[UTP]L:1227 |
x,y,z |
1_555 |
10 |
1 |
582 |
44.0 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.209 |
52 |
|
[MG]B:1228 |
1 |
1 |
98 |
f |
[UTP]B:1227 |
x,y,z |
1_555 |
9 |
1 |
587 |
42.9 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.209 |
53 |
|
[MG]I:1228 |
1 |
1 |
98 |
f |
[UTP]I:1227 |
x,y,z |
1_555 |
11 |
1 |
586 |
40.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.209 |
54 |
|
[MG]C:1228 |
1 |
1 |
98 |
f |
[UTP]C:1227 |
x,y,z |
1_555 |
11 |
1 |
588 |
37.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.209 |
55 |
|
[MG]E:1228 |
1 |
1 |
98 |
f |
[UTP]E:1227 |
x,y,z |
1_555 |
10 |
1 |
585 |
35.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.209 |
Average: |
41.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
15 |
56 |
|
[MG]E:1228 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
13 |
6 |
10458 |
44.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.096 |
57 |
|
[MG]C:1228 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
10282 |
43.6 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.096 |
58 |
|
[MG]D:1228 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
10709 |
16.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.096 |
59 |
|
[MG]B:1228 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
10489 |
15.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.096 |
60 |
|
[MG]J:1228 |
1 |
1 |
98 |
f |
J |
x,y,z |
1_555 |
1 |
1 |
10828 |
15.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.096 |
61 |
|
[MG]L:1228 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
1 |
1 |
10700 |
14.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.096 |
62 |
|
[MG]I:1228 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
2 |
2 |
10425 |
11.9 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.096 |
Average: |
23.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.096 |
16 |
63 |
|
B |
5 |
2 |
10489 |
◊ |
J |
x-1/2,y-1/2,z |
3_445 |
2 |
2 |
10828 |
21.5 |
0.1 |
0.700 |
0 |
0 |
0 |
0.000 |
64 |
|
D |
1 |
1 |
10709 |
◊ |
H |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
9200 |
9.1 |
0.3 |
0.816 |
0 |
0 |
0 |
0.000 |
Average: |
15.3 |
0.2 |
0.758 |
0 |
0 |
0 |
0.000 |
17 |
65 |
|
B |
3 |
2 |
10489 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
5 |
3 |
10740 |
18.2 |
0.1 |
0.662 |
0 |
0 |
0 |
0.000 |
18 |
66 |
|
C |
2 |
1 |
10282 |
◊ |
E |
x,y-1,z |
1_545 |
2 |
2 |
10458 |
15.5 |
0.3 |
0.788 |
0 |
0 |
0 |
0.000 |
19 |
67 |
|
[UTP]L:1227 |
1 |
1 |
582 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
10828 |
2.1 |
-0.0 |
0.530 |
0 |
0 |
0 |
0.000 |
68 |
|
[UTP]H:1227 |
1 |
1 |
586 |
◊ |
I |
x,y,z |
1_555 |
1 |
1 |
10425 |
2.0 |
-0.0 |
0.554 |
0 |
0 |
0 |
0.000 |
69 |
|
[UTP]C:1227 |
1 |
1 |
588 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10489 |
0.8 |
-0.0 |
0.544 |
0 |
0 |
0 |
0.000 |
Average: |
1.6 |
-0.0 |
0.543 |
0 |
0 |
0 |
0.000 |
20 |
70 |
|
[UTP]K:1227 |
1 |
1 |
572 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
10803 |
1.1 |
-0.0 |
0.554 |
0 |
0 |
0 |
0.000 |
21 |
71 |
|
[UTP]J:1227 |
1 |
1 |
569 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
10700 |
0.5 |
-0.0 |
0.551 |
0 |
0 |
0 |
0.000 |
|