1OGX

high resolution crystal structure of ketosteroid isomerase mutant d40n(d38n, ti numbering) from pseudomonas putida complexed with equilenin at 2.0 a resolution.

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 97
  • Norm. En. per Res.: -4.7505
• 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	-49.9922	-80.4156	-330.391	-460.7988	97	10	10	12749	4	14	6

Interface residues

• A-B: ALA118A, ALA206B, ALA276B, ALA283B, ALA318B, ALA6A, ALA76A, ALA83A, ARG106A, ARG275B, ARG287B, ARG306B, ARG75A, ARG87A, ASN124A, ASN279B, ASN324B, ASN79A, ASP100A, ASP103A, ASP300B, ASP303B, CYS269B, CYS281B, CYS69A, CYS81A, GLN10A, GLN117A, GLN207B, GLN210B, GLN244B, GLN317B, GLN44A, GLN7A, GLU122A, GLU208B, GLU239B, GLU322B, GLU8A, GLY243B, GLY272B, GLY280B, GLY282B, GLY43A, GLY72A, GLY80A, GLY82A, HIS278B, HIS78A, ILE102A, ILE302B, LEU270B, LEU299B, LEU70A, LEU99A, MET105A, MET13A, MET213B, MET284B, MET305B, MET84A, PHE242B, PHE286B, PHE42A, PHE86A, PRO241B, PRO273B, PRO285B, PRO41A, PRO73A, PRO85A, SER121A, SER126A, SER277B, SER321B, SER326B, SER77A, THR205B, THR271B, THR5A, THR71A, TRP120A, TRP320B, TYR119A, TYR319B, VAL101A, VAL104A, VAL123A, VAL209B, VAL274B, VAL288B, VAL301B, VAL304B, VAL323B, VAL74A, VAL88A, VAL9A