3S1K

the development of peptide-based tools for the analysis of angiogenesis

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-W
  • Int. Res.: 50
  • Norm. En. per Res.: -2.8512
• Hub Node: A(2)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-V	-17.5142	-11.8711	-63.1074	-92.4927	37	3	1	2678	1	4	2
A-W	-11.3369	13.7235	-144.947	-142.5604	50	5	4	5109	1	11	12
B-V	-21.3869	9.9502	-134.705	-146.1417	52	5	4	5136	2	13	12
B-W	-11.0191	-11.9905	-69.118	-92.1276	34	6	3	2647	1	3	1
V-W	-91.6253	-50.3489	1009.14	867.1658	119	18	10	15188	2	17	17

Interface residues

• A-V: ALA11A, ALA13A, ALA17A, ARG82V, ASN10A, ASN21A, ASN23A, ASN52A, ASP24A, GLN25A, GLN26A, GLN79V, GLN89V, GLU15A, GLU7A, GLY88V, GLY92V, HIS28A, HIS86V, HIS90V, ILE14A, ILE16A, ILE31A, ILE46V, ILE80V, ILE83V, ILE91V, LEU18A, LEU19A, LEU22A, LYS48V, MET81V, PHE27A, PRO20A, PRO49V, PRO57A, TRP32A
• A-W: ALA11A, ALA13A, ALA17A, ALA29A, ARG23W, ASN10A, ASN23A, ASN62W, ASP19W, ASP24A, ASP36A, ASP37A, ASP63W, CYS104W, CYS26W, CYS60W, CYS61W, GLN22W, GLN25A, GLN26A, GLU15A, GLU64W, GLU7A, GLY65W, HIS27W, HIS28A, HIS9A, ILE14A, ILE16A, ILE31A, ILE35A, LEU18A, LEU34A, LEU66W, LYS16W, LYS6A, MET18W, MET8A, PHE17W, PHE27A, PRO38A, SER24W, SER41A, TRP32A, TYR12A, TYR21W, TYR25W, VAL14W, VAL15W, VAL20W
• B-V: ALA11B, ALA13B, ALA17B, ALA29B, ARG23V, ASN10B, ASN23B, ASN62V, ASP19V, ASP24B, ASP36B, ASP37B, ASP63V, CYS104V, CYS26V, CYS60V, CYS61V, GLN22V, GLN25B, GLN26B, GLU13V, GLU15B, GLU64V, GLU7B, GLY65V, HIS27V, HIS28B, HIS9B, ILE14B, ILE16B, ILE31B, ILE35B, LEU18B, LEU34B, LEU66V, LYS16V, LYS6B, MET18V, MET8B, PHE17V, PHE27B, PHE30B, PRO38B, SER24V, SER41B, TRP32B, TYR12B, TYR21V, TYR25V, VAL14V, VAL15V, VAL20V
• B-W: ALA11B, ALA13B, ALA17B, ARG82W, ASN10B, ASN21B, ASN23B, ASN52B, ASP24B, GLN25B, GLN26B, GLN79W, GLN89W, GLU15B, GLU7B, GLY88W, GLY92W, HIS28B, HIS90W, ILE14B, ILE16B, ILE31B, ILE46W, ILE80W, ILE83W, ILE91W, LEU18B, LEU19B, LEU22B, LYS48W, MET81W, PHE27B, PRO20B, PRO49W
• V-W: ARG23V, ARG23W, ARG56V, ARG56W, ARG82V, ARG82W, ASN62V, ASN62W, ASN75W, ASP19V, ASP19W, ASP34V, ASP34W, ASP63V, ASP63W, CYS26V, CYS26W, CYS51V, CYS51W, CYS57V, CYS57W, CYS60V, CYS60W, CYS61V, CYS61W, CYS68V, CYS68W, GLN22V, GLN22W, GLN79V, GLN79W, GLN98V, GLN98W, GLU13V, GLU30V, GLU30W, GLU64V, GLU64W, GLU93V, GLU93W, GLY58V, GLY58W, GLY59V, GLY59W, GLY92V, GLY92W, HIS27V, HIS27W, HIS90W, ILE29V, ILE29W, ILE35V, ILE35W, ILE46V, ILE46W, ILE76V, ILE76W, ILE80V, ILE80W, ILE83V, ILE83W, ILE91V, ILE91W, LEU32V, LEU32W, LEU54V, LEU54W, LYS16V, LYS16W, LYS48V, LYS48W, MET18V, MET18W, MET55V, MET55W, MET78V, MET78W, MET81V, MET81W, MET94V, MET94W, PHE17V, PHE17W, PHE36V, PHE36W, PHE47V, PHE47W, PHE96V, PHE96W, PRO28V, PRO28W, PRO49V, PRO49W, PRO53V, PRO53W, SER24V, SER24W, SER50V, SER50W, SER95V, SER95W, THR31V, THR31W, THR77V, THR77W, TYR21V, TYR21W, TYR25V, TYR25W, VAL14V, VAL14W, VAL15V, VAL15W, VAL20V, VAL20W, VAL33V, VAL33W, VAL52V, VAL52W