SuMo: A Tool for Protein Function Inference Based on 3D Structures Comparisons - Identification of Ligand Binding Site and Protein-Protein Interaction Area - page 18

Table 1.4 (continued)

Hit Id PDB Id SCF Count Sumo Score Header line of the PDB structure

30 2Q9M 19 10.76 4-substituted trinems as broad

spectrum-lactamase
inhibitors: structure-based
design, synthesis and
biological activity

31 1TEM 19 10.52 6 alpha hydroxymethyl

penicilloic acid acylated on
the TEM- 1 BETA-lactamase
from Escherichia coli

32 2A49 18 10.45 Crystal structure of clavulanic

acid bound TO E166A
VARIANT OF SHV-1 beta-
lactamase

33 2C6W 19 10.32 Penicillin-binding protein 1a

(PBP-1A) from
Streptococcus pneumoniae

34 3DWK 19 10.27 Identi fi cation of dynamic

structural motifs involved
in peptidoglycan
glycosyltransfer

35 1FQG 18 10.15 Molecular structure of the

acyl-enzyme intermediate
in tem- 1 beta-lactamase

36 3BFC 21 9.98 Class a beta-lactamase sed-

G238C complexed with
imipenem

37 1YMS 16 9.93 X-ray crystallographic structure

of CTX-M-9 beta-lactamase
complexed with nafcinin-like
boronic acid inhibitor

38 1XKZ 17 9.87 Crystal structure of the acylated

beta-lactam sensor domain
of BLAR1 from S. aureus

39 1BLS 17 9.86 Crystallographic structure of a

phosphonate derivative of the
enterobacter cloacae p99
cephalosporinase: mechanis-
tic interpretation of a
beta-lactamase transition
state analog

40 1VQQ 17 9.80 Structure of penicillin binding

protein 2a from methicillin
resistant Staphylococcus
aureus.

41 2ZQD 16 9.80 Ceftazidime acyl-intermediate

structure of class a beta-lact
toho-1 E166A/R274N/
R276N TRIPLE MUTANT

(continued)