2ZC5

penicillin-binding protein 1a (pbp 1a) acyl-enzyme complex (biapenem) from streptococcus pneumoniae

• Total interactions analyzed: 6
• Total true interactions: 2
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 61
  • Norm. En. per Res.: -4.7702
• Hub Node: A(1)

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-B	-73.2495	10.2246	-215.958	-278.9829	62	11	9	8352	0	11	15
C-D	-92.4249	7.8315	-206.386	-290.9794	61	11	10	8323	0	10	14

Interface residues

• A-B: ALA306B, ALA64A, ASN267B, ASN290B, ASN301B, ASN58A, ASN60A, ASP273B, ASP297B, ASP303B, ASP57A, ASP65A, GLN304B, GLN307B, GLN61A, GLU305B, GLY295B, HIS503B, ILE280B, ILE342B, ILE502B, ILE55A, ILE63A, LEU276B, LEU291B, LEU292B, LEU625B, LEU62A, LEU66A, LYS277B, LYS308B, LYS340B, LYS504B, LYS54A, LYS59A, MET272B, MET296B, PHE356B, PRO269B, SER355B, SER508B, SER52A, SER53A, THR293B, THR294B, THR300B, THR51A, TYR268B, TYR271B, TYR275B, TYR289B, TYR299B, TYR501B, TYR56A, TYR591B, VAL279B, VAL283B, VAL298B, VAL302B, VAL341B, VAL505B, VAL506B
• C-D: ALA306D, ALA64C, ASN267D, ASN290D, ASN301D, ASN58C, ASN60C, ASP273D, ASP297D, ASP303D, ASP335D, ASP57C, ASP65C, GLN304D, GLN307D, GLN61C, GLU305D, GLY295D, HIS503D, ILE280D, ILE342D, ILE502D, ILE55C, ILE63C, LEU276D, LEU291D, LEU292D, LEU62C, LEU66C, LYS277D, LYS308D, LYS340D, LYS504D, LYS54C, LYS59C, MET272D, MET296D, PHE356D, PRO269D, SER355D, SER52C, SER53C, THR293D, THR294D, THR300D, THR51C, TYR268D, TYR271D, TYR275D, TYR289D, TYR299D, TYR501D, TYR56C, TYR591D, VAL279D, VAL283D, VAL298D, VAL302D, VAL341D, VAL505D, VAL506D